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Methyl 2-(benzo[b]thiophen-2-yl)hexanoate
SpectraBase Compound ID P8PgCJ5HuZ
InChI InChI=1S/C15H18O2S/c1-3-4-8-12(15(16)17-2)14-10-11-7-5-6-9-13(11)18-14/h5-7,9-10,12H,3-4,8H2,1-2H3
InChIKey KRPRPAPAQBDLOZ-UHFFFAOYSA-N
Mol Weight 262.37 g/mol
Molecular Formula C15H18O2S
Exact Mass 262.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2KeuEhTAjoR
Name Methyl 2-(benzo[b]thiophen-2-yl)hexanoate
Appearance Yellow oil
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Formula C15H18O2S
InChI InChI=1S/C15H18O2S/c1-3-4-8-12(15(16)17-2)14-10-11-7-5-6-9-13(11)18-14/h5-7,9-10,12H,3-4,8H2,1-2H3
InChIKey KRPRPAPAQBDLOZ-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202100782
Molecular Weight 262.367 g/mol
Reported Formula C15H18O2S
SMILES c1(C(C(OC)=O)CCCC)cc2c(s1)cccc2
SPLASH splash10-0002-0930000000-7084ca4a6ad54a67f2ec
Source of Spectrum ASC-363-4619-2m
Wiley ID 1851304