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Heptyl isopropyl sulfide
SpectraBase Compound ID 3nEOGHtynP7
InChI InChI=1S/C10H22S/c1-4-5-6-7-8-9-11-10(2)3/h10H,4-9H2,1-3H3
InChIKey DBPSYWLCQUZHGD-UHFFFAOYSA-N
Mol Weight 174.35 g/mol
Molecular Formula C10H22S
Exact Mass 174.144222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GMjrpUAZKsA
Name Heptyl isopropyl sulfide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H22S
InChI InChI=1S/C10H22S/c1-4-5-6-7-8-9-11-10(2)3/h10H,4-9H2,1-3H3
InChIKey DBPSYWLCQUZHGD-UHFFFAOYSA-N
Molecular Weight 174.346 g/mol
SMILES C(SCCCCCCC)(C)C
SPLASH splash10-0536-9300000000-8df93f2a66374431938e
Source of Spectrum SO-0-466-2
Synonyms 1-(Isopropylsulfanyl)heptane 1-(propan-2-ylthio)heptane 1-Isopropylsulfanylheptane 1-Propan-2-ylsulfanylheptane
Wiley ID 1543170