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(E)-3-(benzylamino)-3-(methylthio)-2-(2-pyridyl)acrylonitrile
SpectraBase Compound ID 5hRA4VKPPLo
InChI InChI=1S/C16H15N3S/c1-20-16(19-12-13-7-3-2-4-8-13)14(11-17)15-9-5-6-10-18-15/h2-10,19H,12H2,1H3/b16-14-
InChIKey BHVINGNPOKDHJR-PEZBUJJGSA-N
Mol Weight 281.38 g/mol
Molecular Formula C16H15N3S
Exact Mass 281.098669 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 93uSTvXd5bP
Name (E)-3-(benzylamino)-3-(methylthio)-2-(2-pyridyl)acrylonitrile
CAS Registry Number 122851-62-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15N3S
InChI InChI=1S/C16H15N3S/c1-20-16(19-12-13-7-3-2-4-8-13)14(11-17)15-9-5-6-10-18-15/h2-10,19H,12H2,1H3/b16-14-
InChIKey BHVINGNPOKDHJR-PEZBUJJGSA-N
Molecular Weight 281.377 g/mol
SMILES N(\C(=C/(C#N)c1ncccc1)SC)Cc1ccccc1
SPLASH splash10-001i-0090000000-5a8af9ccc8a5c5521ad3
Source of Spectrum F-45-1809-8
Synonyms (E)-3-(benzylamino)-3-methylsulfanyl-2-(2-pyridyl)prop-2-enenitrile (E)-3-(benzylamino)-3-methylsulfanyl-2-pyridin-2-ylprop-2-enenitrile (E)-3-(methylthio)-3-[(phenylmethyl)amino]-2-(2-pyridinyl)-2-propenenitrile (E)-3-methylsulfanyl-3-[(phenylmethyl)amino]-2-pyridin-2-yl-prop-2-enenitrile
Wiley ID 1284928