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2-tert-Butylthio-5-chlorobenzaldehyde
SpectraBase Compound ID HBVJinbhvsZ
InChI InChI=1S/C11H13ClOS/c1-11(2,3)14-10-5-4-9(12)6-8(10)7-13/h4-7H,1-3H3
InChIKey ORFLGTHTPWRAIW-UHFFFAOYSA-N
Mol Weight 228.74 g/mol
Molecular Formula C11H13ClOS
Exact Mass 228.037564 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9jSdA01XZhn
Name 2-tert-Butylthio-5-chlorobenzaldehyde
Alternate Name(s) 2-(tert-butylthio)-5-chlorobenzaldehyde 2-tert-butylsulfanyl-5-chlorobenzaldehyde 2-tert-butylsulfanyl-5-chloro-benzaldehyde 2-tert-butylsulfanyl-5-chloranyl-benzaldehyde
Comments Less than 3 mono-isotopic peaks
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Formula C11H13ClOS
InChI InChI=1S/C11H13ClOS/c1-11(2,3)14-10-5-4-9(12)6-8(10)7-13/h4-7H,1-3H3
InChIKey ORFLGTHTPWRAIW-UHFFFAOYSA-N
Molecular Weight 228.737 g/mol
SMILES c1(c(SC(C)(C)C)ccc(c1)Cl)C=O
SPLASH splash10-004i-0090000000-9ea0c12ba08b18e74bb6
Source of Spectrum Y-46-1025-2c
Wiley ID 1666896