Brightway Flows 1.0
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Ammonium

fo-e8f4bd71ae8a6d51

Identity

Type
Molecular cation
CAS
14798-03-9
EC
—
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Ammonium

Alternative labels

15

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 1
InChI2D key string chemrof:inchi2d_key_string QGZKDVFQNNGYKY-UHFFFAOYSA-O
InChI2D string chemrof:inchi2d_string InChI=1S/H3N/h1H3/p+1
IUPAC name chemrof:IUPAC_name Ammonium
Molecular formula chemrof:molecular_formula H4N, H4N+
Molecular mass chemrof:molecular_mass 18.039
Monoisotopic mass chemrof:monoisotopic_mass 18.033826, 18.03383
SMILES string chemrof:smiles_string [NH4+]

Known URLs

40

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=14798-03-9 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:28938 enrich_references.chebi_id_link
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID5043974 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID601315577 enrich_references.pubchem_identifier_url
gmelin gmelin:84 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/54S68520I4 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0041827 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J231.669B enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J643.962D enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C01342 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C01342 enrich_references.pubchem_identifier_url
MetaCyc https://metacyc.org/compound?orgid=META&id=AMMONIUM enrich_references.chebi_xrefs
molbase molbase:929 enrich_references.chebi_xrefs
pdb-ccd pdb-ccd:NH4 enrich_references.chebi_xrefs
pharmgkb.org https://www.pharmgkb.org/chemical/PA166131461 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/223 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=114551 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/11319011 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/11341317 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/12096804 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/14512268 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/14879753 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/16345391 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/16903292 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/17392693 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/18515490 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/19199063 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/19596600 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/19682559 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/19716251 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/21993530 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22265469 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22524020 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22562341 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22631217 enrich_references.chebi_xrefs
reaxys reaxys:16093784 enrich_references.chebi_xrefs
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/1313310 enrich_references.pubchem_identifier_url
Wikidata https://www.wikidata.org/wiki/Q190901 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Ammonium enrich_references.chebi_xrefs
Wikipedia https://en.wikipedia.org/wiki/Nitrenium_ion enrich_references.pubchem_identifier_url

Elementary flows

16
Flow Context Source Unit CFs
32cd2181-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 6
08a91e70-3ddc-11dd-91cf-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 6
fabf6951-402e-447e-b059-e870f5e57541 Environmental → Air → Indoor EF 3.1 kg 4
08a91e70-3ddc-11dd-91ce-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 2
08a91e70-3ddc-11dd-91d0-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 6
08a91e70-3ddc-11dd-954d-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 6
32cd2180-6556-11dd-ad8b-0800200c9a66 Environmental → Ground → Agricultural EF 3.1 kg 4
32cd2182-6556-11dd-ad8b-0800200c9a66 Environmental → Ground → Non-agricultural EF 3.1 kg 4
32cd2183-6556-11dd-ad8b-0800200c9a66 Environmental → Ground → Unknown EF 3.1 kg 4
13c45798a7be61b6df78bc4ef57a8f06110e4c08 Environmental → Water → Lake bafu algorithm addition kg 0
08a91e70-3ddc-11dd-97d3-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 1
08a91e70-3ddc-11dd-97d5-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 5
26776d18d147fb09dcef6c8f068af3deda7e3779 Environmental → Water → River bafu algorithm addition kg 0
fe0acd60-3ddc-11dd-aaa5-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 5
9d0cb1337dc0c2fd8a13b828880ac1e92a028b1a Environmental → Water → Unconfined aquifer ecoinvent algorithm addition kg 0
08a91e70-3ddc-11dd-97d4-0050c2490048 Environmental → Water → Unknown EF 3.1 kg 5

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-e8f4bd71ae8a6d51",
  "prefLabel": [
    {
      "@value": "Ammonium",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "[NH4](+)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "http://purl.obolibrary.org/obo/CHEBI_28938"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Ammonia ion (NH4+)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ammonia, ion (NH41+)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:14798-03-9",
          "EF 3.1",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ammonium (NH4+)",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "ammonium cation",
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    },
    {
      "@value": "ammonium ion",
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    },
    {
      "@value": "Ammonium ion (NH4+)",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ammonium ion(+)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
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      }
    },
    {
      "@value": "Ammonium ion(1+)",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ammonium nitrogen ((NH4)N)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ammonium(1+)",
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "azanium",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "NH(4)(+)",
      "@language": "en",
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      "provenance": {
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      }
    },
    {
      "@value": "NH4(+)",
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      }
    },
    {
      "@value": "NH4+",
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      "provenance": {
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  ],
  "properties": {
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      ],
      "attested_by": {
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          "enrich_references.chebi_semantic"
        ],
        "H4N+": [
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          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "Molecular formula",
      "provenance": [
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        },
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          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
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      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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        },
        {
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          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[NH4+]"
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        }
      ],
      "attested_by": {
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    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
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      "attested_by": {
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    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
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        {
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          "prov:hadPrimarySource": [
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    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "@value": [
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      ],
      "attested_by": {
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      },
      "rdfs:label": "Molecular mass",
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      "provenance": [
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          "prov:hadPrimarySource": [
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    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
      "@id": "https://w3id.org/chemrof/monoisotopic_mass",
      "@value": [
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      ],
      "attested_by": {
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        "18.033826": [
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      "rdfs:label": "Monoisotopic mass",
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        },
        {
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          "prov:hadPrimarySource": [
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          ]
        },
        {
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          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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    },
    "https://w3id.org/chemrof/elemental_charge": {
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      "@value": [
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      "attested_by": {
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      "rdfs:label": "Elemental charge",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi.basic_property_values.charge"
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
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      ],
      "provenance": {
        "prov:wasGeneratedBy": "opsin_iupac",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ]
      },
      "attested_by": {
        "Ammonium": [
          "opsin_iupac"
        ]
      }
    }
  },
  "references": [
    {
      "@id": "gmelin:84",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi.xrefs_urls"
      }
    },
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J231.669B",
      "provenance": {
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        ],
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      }
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