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3-Phenylthio-4-n-propylhepta-1,3-diene
SpectraBase Compound ID PTob9eW3S6
InChI InChI=1S/C16H22S/c1-4-10-14(11-5-2)16(6-3)17-15-12-8-7-9-13-15/h6-9,12-13H,3-5,10-11H2,1-2H3
InChIKey BZGLIMLCBCKIJX-UHFFFAOYSA-N
Mol Weight 246.41 g/mol
Molecular Formula C16H22S
Exact Mass 246.144222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JjBdpZ6nteF
Name 3-Phenylthio-4-n-propylhepta-1,3-diene
Alternate Name(s) phenyl 2-propyl-1-vinyl-1-pentenyl sulfide [(2-propyl-1-vinyl-1-pentenyl)sulfanyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22S
InChI InChI=1S/C16H22S/c1-4-10-14(11-5-2)16(6-3)17-15-12-8-7-9-13-15/h6-9,12-13H,3-5,10-11H2,1-2H3
InChIKey BZGLIMLCBCKIJX-UHFFFAOYSA-N
Molecular Weight 246.412 g/mol
SMILES C(Sc1ccccc1)(=C(CCC)CCC)C=C
SPLASH splash10-054n-8980000000-eb4a46c8ee3fed692516
Source of Spectrum C-99-3097-0
Wiley ID 1249464