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(S,E)-S-Ethyl 5-methyl-7-phenylhep-2-enethioate
SpectraBase Compound ID I7GenukBNbF
InChI InChI=1S/C16H22OS/c1-3-18-16(17)11-7-8-14(2)12-13-15-9-5-4-6-10-15/h4-7,9-11,14H,3,8,12-13H2,1-2H3/b11-7+/t14-/m1/s1
InChIKey GGSPWXCNGAOUST-DPQIITEBSA-N
Mol Weight 262.41 g/mol
Molecular Formula C16H22OS
Exact Mass 262.139137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9S4FIEVVtlV
Name (S,E)-S-Ethyl 5-methyl-7-phenylhep-2-enethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22OS
InChI InChI=1S/C16H22OS/c1-3-18-16(17)11-7-8-14(2)12-13-15-9-5-4-6-10-15/h4-7,9-11,14H,3,8,12-13H2,1-2H3/b11-7+/t14-/m1/s1
InChIKey GGSPWXCNGAOUST-DPQIITEBSA-N
Molecular Weight 262.411 g/mol
SMILES C(\C=C\C[C@](CCc1ccccc1)(C)[H])(=O)SCC
SPLASH splash10-0006-9100000000-7809b6b604f4fae63bbc
Source of Spectrum QC-21-1582-13d
Wiley ID 1688434