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indolylmethylisothiocyanate

PropertiesImageOccurences in reactions
MNX_IDMNXM7445Image of MNXM7445
#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 0
formulaC10H8N2S
charge0
mass188.04082
referencemetacycM:CPDQT-429
InChIKeyIUGVJHWSHLFGAU-UHFFFAOYSA-N
InChIInChI=1S/C10H8N2S/c13-7-11-5-8-6-12-10-4-2-1-3-9(8)10/h1-4,6,12H,5H2
SMILESS=C=NCc1c[nH]c2ccccc12
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
metacyc.compound:CPDQT-429
metacycM:CPDQT-429
indolylmethylisothiocyanate
indol-3-ylmethylisothiocyanate
seed.compound:cpd26651
seedM:cpd26651
indol-3-ylmethylisothiocyanate
indolylmethylisothiocyanate
seedM:M_cpd26651 secondary/obsolete/fantasy identifier