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3-Heptene, 7-(ethylthio)-
SpectraBase Compound ID JhZCILJTZCy
InChI InChI=1S/C9H18S/c1-3-5-6-7-8-9-10-4-2/h5-6H,3-4,7-9H2,1-2H3/b6-5+
InChIKey AUSABVVROLWDGA-AATRIKPKSA-N
Mol Weight 158.3 g/mol
Molecular Formula C9H18S
Exact Mass 158.112922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gc3EIVE9KdP
Name 3-Heptene, 7-(ethylthio)-
CAS Registry Number 55320-20-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18S
InChI InChI=1S/C9H18S/c1-3-5-6-7-8-9-10-4-2/h5-6H,3-4,7-9H2,1-2H3/b6-5+
InChIKey AUSABVVROLWDGA-AATRIKPKSA-N
Molecular Weight 158.303 g/mol
SMILES CCSCCC\C=C\CC
SPLASH splash10-0560-9100000000-731e8908330b6eed5706
Source of Spectrum SD-1981-0-0
Synonyms (3E)-7-(Ethylsulfanyl)-3-heptene (E)-7-(ethylthio)-3-heptene (E)-7-(ethylthio)hept-3-ene (E)-7-ethylsulfanylhept-3-ene
Wiley ID 1155613