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4-Neopentylbenzene-1-sulfonyl chloride
SpectraBase Compound ID 3OeW887BsEh
InChI InChI=1S/C11H15ClO2S/c1-11(2,3)8-9-4-6-10(7-5-9)15(12,13)14/h4-7H,8H2,1-3H3
InChIKey JHOGTDTUILPHQC-UHFFFAOYSA-N
Mol Weight 246.75 g/mol
Molecular Formula C11H15ClO2S
Exact Mass 246.048129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EdPvFq0IK3S
Name 4-Neopentylbenzene-1-sulfonyl chloride
Alternate Name(s) 4-(2,2-dimethylpropyl)benzenesulfonyl chloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15ClO2S
InChI InChI=1S/C11H15ClO2S/c1-11(2,3)8-9-4-6-10(7-5-9)15(12,13)14/h4-7H,8H2,1-3H3
InChIKey JHOGTDTUILPHQC-UHFFFAOYSA-N
Molecular Weight 246.752 g/mol
SMILES c1(S(=O)(=O)Cl)ccc(CC(C)(C)C)cc1
SPLASH splash10-0a4i-9010000000-8332e9015e17e1596866
Source of Spectrum CRT-16-278-H
Wiley ID 1710027