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(E)-2-(1-Methyl-3-phenylthiopent-2-enyl)cyclohexanone
SpectraBase Compound ID FmOW62wPyqH
InChI InChI=1S/C18H24OS/c1-3-15(20-16-9-5-4-6-10-16)13-14(2)17-11-7-8-12-18(17)19/h4-6,9-10,13-14,17H,3,7-8,11-12H2,1-2H3/b15-13+
InChIKey IRWNWRQPFOHCLB-FYWRMAATSA-N
Mol Weight 288.45 g/mol
Molecular Formula C18H24OS
Exact Mass 288.154787 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EwkM5bvSzSc
Name (E)-2-(1-Methyl-3-phenylthiopent-2-enyl)cyclohexanone
Alternate Name(s) 2-[(2E)-1-methyl-3-(phenylsulfanyl)-2-pentenyl]cyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24OS
InChI InChI=1S/C18H24OS/c1-3-15(20-16-9-5-4-6-10-16)13-14(2)17-11-7-8-12-18(17)19/h4-6,9-10,13-14,17H,3,7-8,11-12H2,1-2H3/b15-13+
InChIKey IRWNWRQPFOHCLB-FYWRMAATSA-N
Molecular Weight 288.449 g/mol
SMILES c1(S\C(=C\C(C2C(=O)CCCC2)C)CC)ccccc1
SPLASH splash10-054o-9500000000-ceb285ac5e2c8285722e
Source of Spectrum F-50-9392-18
Wiley ID 1291943