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Methyl 2-[1-(benzylthio)cyclopropyl]-2-chloroacetate
SpectraBase Compound ID JDfMksLtVQ7
InChI InChI=1S/C13H15ClO2S/c1-16-12(15)11(14)13(7-8-13)17-9-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3
InChIKey QKQJGOZZWVXPAC-UHFFFAOYSA-N
Mol Weight 270.77 g/mol
Molecular Formula C13H15ClO2S
Exact Mass 270.048129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 71DD3GzjPXe
Name Methyl 2-[1-(Benzylthio)cyclopropyl]-2-chloroacetate
Alternate Name(s) Methyl 2-(1-(benzylthio)cyclopropyl)-2-chloroacetate
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Formula C13H15ClO2S
InChI InChI=1S/C13H15ClO2S/c1-16-12(15)11(14)13(7-8-13)17-9-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3
InChIKey QKQJGOZZWVXPAC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19921250418
Molecular Weight 270.774 g/mol
SMILES C1CC1(C(C(OC)=O)Cl)SCc1ccccc1
SPLASH splash10-0006-9110000000-cefca800246b96f5ae28
Source of Spectrum K-125-874-14a_[SBzl]
Wiley ID 1792264