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2-Piperidinecarbonitrile, 3-ethyl-1-methyl-4-(phenylthio)-
SpectraBase Compound ID JgmjY0p04lS
InChI InChI=1S/C15H20N2S/c1-3-13-14(11-16)17(2)10-9-15(13)18-12-7-5-4-6-8-12/h4-8,13-15H,3,9-10H2,1-2H3
InChIKey LEMKWJRMWDUHLO-UHFFFAOYSA-N
Mol Weight 260.4 g/mol
Molecular Formula C15H20N2S
Exact Mass 260.13472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3xTxPJk3QMc
Name 2-Piperidinecarbonitrile, 3-ethyl-1-methyl-4-(phenylthio)-
CAS Registry Number 73657-77-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20N2S
InChI InChI=1S/C15H20N2S/c1-3-13-14(11-16)17(2)10-9-15(13)18-12-7-5-4-6-8-12/h4-8,13-15H,3,9-10H2,1-2H3
InChIKey LEMKWJRMWDUHLO-UHFFFAOYSA-N
Molecular Weight 260.399 g/mol
SMILES C1(C(C(Sc2ccccc2)CCN1C)CC)C#N
SPLASH splash10-0w90-0920000000-514eaf62ee55c2aae470
Source of Spectrum C-102-1075-0
Synonyms 3-Ethyl-1-methyl-4-(phenylsulfanyl)-2-piperidinecarbonitrile Mixture of isomers of 1-methyl-2-cyano-3-ethyl-4-thiophenylpiperidine
Wiley ID 1263905