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2,6-difluorobenzamide
| Flow Object ID | fo-3ab6e03f45ff8762 | ||||||
|---|---|---|---|---|---|---|---|
| Type | Consensus | ||||||
| prefLabel |
|
||||||
| Alt Labels |
|
||||||
| CAS Numbers |
18063-03-1
|
||||||
| EC Numbers |
241-972-8
|
||||||
| Changes Applied | 26 |
Provenance
| Field | Value |
|---|---|
| Resolver | hybrid_name_cas_v1 |
| Seed Source | EF 3.1 |
| Seed Flow | 0d320748-ccf8-4440-beeb-f0fcca13710e |
Properties
| Predicate | Value |
|---|---|
| InChIKey |
AVRQBXVUUXHRMY-UHFFFAOYSA-N
|
| InChI |
InChI=1S/C7H5F2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)
|
| IUPAC name |
2,6-bis(fluoranyl)benzamide, 2,6-difluorobenzamide
|
| Molecular formula |
C7H5F2NO
|
| Molecular mass |
157.119
|
| Monoisotopic mass |
157.03392
|
| SMILES |
C1=CC(=C(C(=C1)F)C(=O)N)F, NC(=O)c1c(F)cccc1F
|
References
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J43.076E
- https://chem.echa.europa.eu/100.038.142
- https://commonchemistry.cas.org/detail?cas_rn=18063-03-1
- https://comptox.epa.gov/dashboard/DTXSID4073417
- https://gsrs.ncats.nih.gov/ginas/app/beta/substances/SJ2RN214MK
- https://pubchem.ncbi.nlm.nih.gov/compound/87439
- https://www.wikidata.org/wiki/Q15632832
Linked Elementary Flows
| UUID | Source | Unit | Context | LCIA Factors | Consensus Changes |
|---|---|---|---|---|---|
a67d42a6… |
EF 3.1 | kg | Environmental → Air → Aircraft cruise height | 2 | 2 |
0d320748… |
EF 3.1 | kg | Environmental → Air → Ground level → Rural (<1000 people/square mile) | 0 | 2 |
b5c35331… |
EF 3.1 | kg | Environmental → Air → Ground level → Urban (>1000 people/square mile) | 2 | 2 |
7d14d336… |
EF 3.1 | kg | Environmental → Air → High stack, >150 meters | 2 | 2 |
9660abec… |
EF 3.1 | kg | Environmental → Air → Unknown | 2 | 2 |
b8b93ec6… |
EF 3.1 | kg | Environmental → Air → Unknown | 2 | 2 |
10fc5fd1… |
EF 3.1 | kg | Environmental → Ground → Agricultural | 2 | 2 |
19c35afb… |
EF 3.1 | kg | Environmental → Ground → Unknown | 2 | 2 |
1bfa6458… |
EF 3.1 | kg | Environmental → Water → Ocean | 2 | 2 |
f1718fef… |
EF 3.1 | kg | Environmental → Water → Surface water | 2 | 2 |
a9c23240… |
EF 3.1 | kg | Environmental → Water → Unknown | 2 | 2 |
▶
Changes Applied
| Elementary Flow | Field | Old Value | New Value | Comment |
|---|---|---|---|---|
0d320748… |
altLabel |
— |
[{"@value":"Benzamide, 2,6-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:18063-03-1","https://commonchemistry.cas.org/detail?cas_rn=18063-03-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=18063-03-1; added Common Chemistry CAS names as altLabel: Benzamide, 2,6-difluoro-; object_uuid=fo-3ab6e03f45ff8762 |
0d320748… |
cas_match_labels |
— |
{"18063-03-1":"exactMatch"} |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'18063-03-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3ab6e03f45ff8762: {'18063-03-1': 'exactMatch'} |
10fc5fd1… |
altLabel |
— |
[{"@value":"Benzamide, 2,6-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:18063-03-1","https://commonchemistry.cas.org/detail?cas_rn=18063-03-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=18063-03-1; added Common Chemistry CAS names as altLabel: Benzamide, 2,6-difluoro-; object_uuid=fo-3ab6e03f45ff8762 |
10fc5fd1… |
cas_match_labels |
— |
{"18063-03-1":"exactMatch"} |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'18063-03-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3ab6e03f45ff8762: {'18063-03-1': 'exactMatch'} |
19c35afb… |
altLabel |
— |
[{"@value":"Benzamide, 2,6-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:18063-03-1","https://commonchemistry.cas.org/detail?cas_rn=18063-03-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=18063-03-1; added Common Chemistry CAS names as altLabel: Benzamide, 2,6-difluoro-; object_uuid=fo-3ab6e03f45ff8762 |
19c35afb… |
cas_match_labels |
— |
{"18063-03-1":"exactMatch"} |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'18063-03-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3ab6e03f45ff8762: {'18063-03-1': 'exactMatch'} |
1bfa6458… |
altLabel |
— |
[{"@value":"Benzamide, 2,6-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:18063-03-1","https://commonchemistry.cas.org/detail?cas_rn=18063-03-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=18063-03-1; added Common Chemistry CAS names as altLabel: Benzamide, 2,6-difluoro-; object_uuid=fo-3ab6e03f45ff8762 |
1bfa6458… |
cas_match_labels |
— |
{"18063-03-1":"exactMatch"} |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'18063-03-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3ab6e03f45ff8762: {'18063-03-1': 'exactMatch'} |
7d14d336… |
altLabel |
— |
[{"@value":"Benzamide, 2,6-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:18063-03-1","https://commonchemistry.cas.org/detail?cas_rn=18063-03-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=18063-03-1; added Common Chemistry CAS names as altLabel: Benzamide, 2,6-difluoro-; object_uuid=fo-3ab6e03f45ff8762 |
7d14d336… |
cas_match_labels |
— |
{"18063-03-1":"exactMatch"} |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'18063-03-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3ab6e03f45ff8762: {'18063-03-1': 'exactMatch'} |
9660abec… |
altLabel |
— |
[{"@value":"Benzamide, 2,6-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:18063-03-1","https://commonchemistry.cas.org/detail?cas_rn=18063-03-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=18063-03-1; added Common Chemistry CAS names as altLabel: Benzamide, 2,6-difluoro-; object_uuid=fo-3ab6e03f45ff8762 |
9660abec… |
cas_match_labels |
— |
{"18063-03-1":"exactMatch"} |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'18063-03-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3ab6e03f45ff8762: {'18063-03-1': 'exactMatch'} |
a67d42a6… |
altLabel |
— |
[{"@value":"Benzamide, 2,6-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:18063-03-1","https://commonchemistry.cas.org/detail?cas_rn=18063-03-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=18063-03-1; added Common Chemistry CAS names as altLabel: Benzamide, 2,6-difluoro-; object_uuid=fo-3ab6e03f45ff8762 |
a67d42a6… |
cas_match_labels |
— |
{"18063-03-1":"exactMatch"} |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'18063-03-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3ab6e03f45ff8762: {'18063-03-1': 'exactMatch'} |
a9c23240… |
altLabel |
— |
[{"@value":"Benzamide, 2,6-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:18063-03-1","https://commonchemistry.cas.org/detail?cas_rn=18063-03-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=18063-03-1; added Common Chemistry CAS names as altLabel: Benzamide, 2,6-difluoro-; object_uuid=fo-3ab6e03f45ff8762 |
a9c23240… |
cas_match_labels |
— |
{"18063-03-1":"exactMatch"} |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'18063-03-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3ab6e03f45ff8762: {'18063-03-1': 'exactMatch'} |
b5c35331… |
altLabel |
— |
[{"@value":"Benzamide, 2,6-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:18063-03-1","https://commonchemistry.cas.org/detail?cas_rn=18063-03-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=18063-03-1; added Common Chemistry CAS names as altLabel: Benzamide, 2,6-difluoro-; object_uuid=fo-3ab6e03f45ff8762 |
b5c35331… |
cas_match_labels |
— |
{"18063-03-1":"exactMatch"} |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'18063-03-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3ab6e03f45ff8762: {'18063-03-1': 'exactMatch'} |
b8b93ec6… |
altLabel |
— |
[{"@value":"Benzamide, 2,6-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:18063-03-1","https://commonchemistry.cas.org/detail?cas_rn=18063-03-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=18063-03-1; added Common Chemistry CAS names as altLabel: Benzamide, 2,6-difluoro-; object_uuid=fo-3ab6e03f45ff8762 |
b8b93ec6… |
cas_match_labels |
— |
{"18063-03-1":"exactMatch"} |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'18063-03-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3ab6e03f45ff8762: {'18063-03-1': 'exactMatch'} |
ecc9da0b… |
altLabel |
— |
[{"@value":"Benzamide, 2,6-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:18063-03-1","https://commonchemistry.cas.org/detail?cas_rn=18063-03-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=18063-03-1; added Common Chemistry CAS names as altLabel: Benzamide, 2,6-difluoro-; object_uuid=fo-3ab6e03f45ff8762 |
ecc9da0b… |
cas_match_labels |
— |
{"18063-03-1":"exactMatch"} |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'18063-03-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3ab6e03f45ff8762: {'18063-03-1': 'exactMatch'} |
f1718fef… |
altLabel |
— |
[{"@value":"Benzamide, 2,6-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:18063-03-1","https://commonchemistry.cas.org/detail?cas_rn=18063-03-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=18063-03-1; added Common Chemistry CAS names as altLabel: Benzamide, 2,6-difluoro-; object_uuid=fo-3ab6e03f45ff8762 |
f1718fef… |
cas_match_labels |
— |
{"18063-03-1":"exactMatch"} |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'18063-03-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3ab6e03f45ff8762: {'18063-03-1': 'exactMatch'} |
fd721a7b… |
altLabel |
— |
[{"@value":"Benzamide, 2,6-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:18063-03-1","https://commonchemistry.cas.org/detail?cas_rn=18063-03-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=18063-03-1; added Common Chemistry CAS names as altLabel: Benzamide, 2,6-difluoro-; object_uuid=fo-3ab6e03f45ff8762 |
fd721a7b… |
cas_match_labels |
— |
{"18063-03-1":"exactMatch"} |
group_key=2,6-difluorobenzamide||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'18063-03-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3ab6e03f45ff8762: {'18063-03-1': 'exactMatch'} |
Flow Object JSON
{
"flow_object_id": "fo-3ab6e03f45ff8762",
"prefLabel": [
{
"@value": "2,6-difluorobenzamide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "prefLabel"
}
}
],
"altLabel": [
{
"@value": "Benzamide, 2,6-difluoro-",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "altLabel"
}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C7H5F2NO"
],
"rdfs:label": "Molecular formula",
"provenance": [
{
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"CID:87439"
],
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},
{
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]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
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"@value": [
"AVRQBXVUUXHRMY-UHFFFAOYSA-N"
],
"rdfs:label": "InChIKey",
"provenance": [
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{
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"prov:hadPrimarySource": [
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]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
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"@value": [
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"NC(=O)c1c(F)cccc1F"
],
"rdfs:label": "SMILES",
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},
{
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},
{
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"prov:hadPrimarySource": [
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}
]
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
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],
"rdfs:label": "InChI",
"provenance": [
{
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},
"https://w3id.org/chemrof/IUPAC_name": {
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"@value": [
"2,6-bis(fluoranyl)benzamide",
"2,6-difluorobenzamide"
],
"rdfs:label": "IUPAC name",
"provenance": {
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],
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}
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"rdfs:label": "Molecular mass",
"@value": [
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],
"provenance": [
{
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"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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]
},
{
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"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C1=CC(=C(C(=C1)F)C(=O)N)F"
]
}
],
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
},
"https://w3id.org/chemrof/monoisotopic_mass": {
"@id": "https://w3id.org/chemrof/monoisotopic_mass",
"rdfs:label": "Monoisotopic mass",
"@value": [
"157.03392"
],
"provenance": [
{
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"prov:wasAttributedTo": "consensus-flow-list",
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},
{
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"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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}
],
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
}
},
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