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3-Mercapto-6-Methyl-2-Heptanone
SpectraBase Compound ID EmDdcF3JMlC
InChI InChI=1S/C8H16OS/c1-6(2)4-5-8(10)7(3)9/h6,8,10H,4-5H2,1-3H3
InChIKey LOAIDFOHKPUHQT-UHFFFAOYSA-N
Mol Weight 160.27 g/mol
Molecular Formula C8H16OS
Exact Mass 160.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J87YNUJIkvQ
Name 3-Mercapto-6-Methyl-2-Heptanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16OS
InChI InChI=1S/C8H16OS/c1-6(2)4-5-8(10)7(3)9/h6,8,10H,4-5H2,1-3H3
InChIKey LOAIDFOHKPUHQT-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 160.275 g/mol
SMILES SC(C(C)=O)CCC(C)C
SPLASH splash10-0536-9100000000-25388107ade8d32a5fb2
Source of Spectrum JP5261185B2
Wiley ID 1852373