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3-Ethyl-7-mercapto-4-phenyl-3-heptanol
SpectraBase Compound ID G3xRcH6FjK0
InChI InChI=1S/C15H24OS/c1-3-15(16,4-2)14(11-8-12-17)13-9-6-5-7-10-13/h5-7,9-10,14,16-17H,3-4,8,11-12H2,1-2H3
InChIKey HTHWRCBUXZVVDW-UHFFFAOYSA-N
Mol Weight 252.42 g/mol
Molecular Formula C15H24OS
Exact Mass 252.154787 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2vaa7uoSpc
Name 3-Ethyl-7-mercapto-4-phenyl-3-heptanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24OS
InChI InChI=1S/C15H24OS/c1-3-15(16,4-2)14(11-8-12-17)13-9-6-5-7-10-13/h5-7,9-10,14,16-17H,3-4,8,11-12H2,1-2H3
InChIKey HTHWRCBUXZVVDW-UHFFFAOYSA-N
Molecular Weight 252.416 g/mol
SMILES SCCCC(C(O)(CC)CC)c1ccccc1
SPLASH splash10-014v-9600000000-857def743fd70d870d78
Source of Spectrum F-53-5569-6
Synonyms 3-Ethyl-4-phenyl-7-sulfanyl-3-heptanol
Wiley ID 801652