(Q105150231)

English

1-isothiocyanato-7-(methylsulfanyl)heptane

chemical compound

In more languages

Statements

type of chemical entity

0 references

chemical compound

0 references

203.080241544 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₉H₁₇NS₂

0 references

canonical SMILES

S=C=NCCCCCCCSC

0 references

Nasturtium officinale

1 reference

Investigation of Brassica oleracea and Nasturtium officinale seeds for the presence of epithiospecifier protein

Identifiers

InChI=1S/C9H17NS2/c1-12-8-6-4-2-3-5-7-10-9-11/h2-8H2,1H3

0 references

LDIRGNDMTOGVRB-UHFFFAOYSA-N

0 references

CAS Registry Number

1 reference

CAS (formerly Chemical Abstracts Service)

25 January 2022

2 references

17 September 2022

based on heuristic

inferred from InChIKey

matched by identifier from

LDIRGNDMTOGVRB-UHFFFAOYSA-N

mapping relation type

2 references

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI=1S/C9H17NS2/c1-12-8-6-4-2-3-5-7-10-9-11/h2-8H2,1H3

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

LDIRGNDMTOGVRB-UHFFFAOYSA-N

UniChem compound ID

1 reference

MassBank accession ID

MSBNK-RIKEN-PR310457

1 reference

LDIRGNDMTOGVRB-UHFFFAOYSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-RIKEN-PR303483

1 reference

LDIRGNDMTOGVRB-UHFFFAOYSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-RIKEN-PR303484

1 reference

LDIRGNDMTOGVRB-UHFFFAOYSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-RIKEN-PR303485

1 reference

LDIRGNDMTOGVRB-UHFFFAOYSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-RIKEN-PR303486

1 reference

LDIRGNDMTOGVRB-UHFFFAOYSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-RIKEN-PR303487

1 reference

LDIRGNDMTOGVRB-UHFFFAOYSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-RIKEN-PR303488

1 reference

LDIRGNDMTOGVRB-UHFFFAOYSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-RIKEN-PR303489

1 reference

LDIRGNDMTOGVRB-UHFFFAOYSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-RIKEN-PR303490

1 reference

LDIRGNDMTOGVRB-UHFFFAOYSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-RIKEN-PR303491

1 reference

LDIRGNDMTOGVRB-UHFFFAOYSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-RIKEN-PR303492

1 reference

LDIRGNDMTOGVRB-UHFFFAOYSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-RIKEN-PR303493

1 reference

LDIRGNDMTOGVRB-UHFFFAOYSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-RIKEN-PR303494

1 reference

LDIRGNDMTOGVRB-UHFFFAOYSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

DSSTox substance ID

DTXSID101282521

1 reference

matched by identifier from

LDIRGNDMTOGVRB-UHFFFAOYSA-N

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

LDIRGNDMTOGVRB-UHFFFAOYSA-N

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

LDIRGNDMTOGVRB-UHFFFAOYSA-N

Sitelinks

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Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)

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