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1-(Chloromethyl)-4-[(butylsulfinyl)methyl]-2,5-dimethylbenzene
SpectraBase Compound ID 1UfNkRn9byt
InChI InChI=1S/C14H21ClOS/c1-4-5-6-17(16)10-14-8-11(2)13(9-15)7-12(14)3/h7-8H,4-6,9-10H2,1-3H3
InChIKey LAPNLEUECBMIQI-UHFFFAOYSA-N
Mol Weight 272.83 g/mol
Molecular Formula C14H21ClOS
Exact Mass 272.100164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JRz0nVwxhcR
Name 1-(Chloromethyl)-4-[(butylsulfinyl)methyl]-2,5-dimethylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21ClOS
InChI InChI=1S/C14H21ClOS/c1-4-5-6-17(16)10-14-8-11(2)13(9-15)7-12(14)3/h7-8H,4-6,9-10H2,1-3H3
InChIKey LAPNLEUECBMIQI-UHFFFAOYSA-N
Molecular Weight 272.834 g/mol
SMILES c1(c(cc(c(c1)C)CS(=O)CCCC)C)CCl
SPLASH splash10-014i-0900000000-c85cc023a4c9ff4018b2
Source of Spectrum J-65-288-4
Synonyms 1-[(butylsulfinyl)methyl]-4-(chloromethyl)-2,5-dimethylbenzene Butyl 4-(chloromethyl)-2,5-dimethylbenzyl sulfoxide 1-(butylsulfinylmethyl)-4-(chloromethyl)-2,5-dimethylbenzene
Wiley ID 1532045