Terminology Service for NFDI4Health
butyl isothiocyanate
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http://purl.obolibrary.org/obo/CHEBI_50534
An isothiocyanate having a butyl group attached to the nitrogen.
Term info
Label
butyl isothiocyanate
Synonyms
- 1-isothiocyanatobutane
Subsets
3_STAR
charge
0
formula
C5H9NS
has obo namespace
chebi_ontology
has related synonym
n-butyl isothiocyanate, BuNCS, isothiocyanic acid n-butyl ester, BITC, isothiocyanic acid, butyl ester, butyl mustard oil, Butylsenfoel
id
CHEBI:50534
inchi
InChI=1S/C5H9NS/c1-2-3-4-6-5-7/h2-4H2,1H3
inchikey
LIMQQADUEULBSO-UHFFFAOYSA-N
mass
115.19770
monoisotopicmass
115.04557
smiles
CCCCN=C=S