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1-Heptanethiol
SpectraBase Compound ID 6JjXHoCy35D
InChI InChI=1S/C7H16S/c1-2-3-4-5-6-7-8/h8H,2-7H2,1H3
InChIKey VPIAKHNXCOTPAY-UHFFFAOYSA-N
Mol Weight 132.26 g/mol
Molecular Formula C7H16S
Exact Mass 132.097272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GUrUHdcwLz5
Name 1-Heptanethiol
CAS Registry Number 1639-09-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H16S
InChI InChI=1S/C7H16S/c1-2-3-4-5-6-7-8/h8H,2-7H2,1H3
InChIKey VPIAKHNXCOTPAY-UHFFFAOYSA-N
Molecular Weight 132.265 g/mol
SMILES SCCCCCCC
SPLASH splash10-0abc-9000000000-8ef562e3b00deef55257
Source of Spectrum EK-1999-462-0
Synonyms Heptane-1-thiol Heptyl mercaptan Heptylthiol n-Heptylmercaptan Normal-heptyl mercaptan BRN 1731687 EINECS 216-678-8 NSC 71119 USAF EK-2122
Wiley ID 1133916