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3-Cyclohexene-1-carboxamide, N,N-bis(1-methylethyl)-2-(phenylthio)-
SpectraBase Compound ID 7zKekDz5qm9
InChI InChI=1S/C19H27NOS/c1-14(2)20(15(3)4)19(21)17-12-8-9-13-18(17)22-16-10-6-5-7-11-16/h5-7,9-11,13-15,17-18H,8,12H2,1-4H3
InChIKey PYJZDTJSBLUQKS-UHFFFAOYSA-N
Mol Weight 317.49 g/mol
Molecular Formula C19H27NOS
Exact Mass 317.181336 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CXbkCBoYQMU
Name 3-Cyclohexene-1-carboxamide, N,N-bis(1-methylethyl)-2-(phenylthio)-
Alternate Name(s) N,N-diisopropyl-2-(phenylsulfanyl)-3-cyclohexene-1-carboxamide N,N-diisopropyl-2-(phenylthio)cyclohex-3-enecarboxamide
CAS Registry Number 109639-64-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H27NOS
InChI InChI=1S/C19H27NOS/c1-14(2)20(15(3)4)19(21)17-12-8-9-13-18(17)22-16-10-6-5-7-11-16/h5-7,9-11,13-15,17-18H,8,12H2,1-4H3
InChIKey PYJZDTJSBLUQKS-UHFFFAOYSA-N
Molecular Weight 317.491 g/mol
SMILES C(C1C(Sc2ccccc2)C=CCC1)(N(C(C)C)C(C)C)=O
SPLASH splash10-004i-5900000000-58b7c8154f4cdc7e9777
Source of Spectrum C-109-5409-24
Wiley ID 1317783