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Benzo[b]thiophene, 2-chloro-3-methyl-
SpectraBase Compound ID Kwdd67NhkRQ
InChI InChI=1S/C9H7ClS/c1-6-7-4-2-3-5-8(7)11-9(6)10/h2-5H,1H3
InChIKey ZJVIZYHPXKIOBB-UHFFFAOYSA-N
Mol Weight 182.67 g/mol
Molecular Formula C9H7ClS
Exact Mass 181.995699 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HEBzdRzB3ie
Name Benzo[b]thiophene, 2-chloro-3-methyl-
Alternate Name(s) 2-chloranyl-3-methyl-1-benzothiophene 2-chloro-3-methyl-1-benzothiophene 2-chloro-3-methyl-benzothiophene
CAS Registry Number 50288-76-1
Comments Less than 3 mono-isotopic peaks
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Formula C9H7ClS
InChI InChI=1S/C9H7ClS/c1-6-7-4-2-3-5-8(7)11-9(6)10/h2-5H,1H3
InChIKey ZJVIZYHPXKIOBB-UHFFFAOYSA-N
Molecular Weight 182.668 g/mol
SMILES c1(sc2ccccc2c1C)Cl
SPLASH splash10-0002-0900000000-ea7dd50445a82471036e
Source of Spectrum AC-1977-272-4
Wiley ID 1178086