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Heptane, 1-bromo-7-(methylthio)-
SpectraBase Compound ID Jkmdxzo0M9E
InChI InChI=1S/C8H17BrS/c1-10-8-6-4-2-3-5-7-9/h2-8H2,1H3
InChIKey KKEYLVXRRZWHRB-UHFFFAOYSA-N
Mol Weight 225.19 g/mol
Molecular Formula C8H17BrS
Exact Mass 224.023435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2GqrtDrc3hx
Name Heptane, 1-bromo-7-(methylthio)-
CAS Registry Number 64053-05-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H17BrS
InChI InChI=1S/C8H17BrS/c1-10-8-6-4-2-3-5-7-9/h2-8H2,1H3
InChIKey KKEYLVXRRZWHRB-UHFFFAOYSA-N
Molecular Weight 225.188 g/mol
SMILES C(SC)CCCCCCBr
SPLASH splash10-03di-9530000000-7773ec99904158df962f
Source of Spectrum W5-18942-0-0
Synonyms 1-Bromo-7-(methylsulfanyl)heptane 7-Bromoheptyl methyl sulfide 1-Bromo-7-methylsulfanylheptane 1-Bromo-7-methylsulfanyl-heptane 1-Bromanyl-7-methylsulfanyl-heptane
Wiley ID 1224477