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2,2-Dimethylpent-4-yn-1-yl4-bromobenzenesulfonate
SpectraBase Compound ID 7dnTpHB8zcU
InChI InChI=1S/C13H15BrO3S/c1-4-9-13(2,3)10-17-18(15,16)12-7-5-11(14)6-8-12/h1,5-8H,9-10H2,2-3H3
InChIKey MCFGRVJSGCYKCZ-UHFFFAOYSA-N
Mol Weight 331.22 g/mol
Molecular Formula C13H15BrO3S
Exact Mass 329.992529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Ch9qYKk6K
Name 2,2-Dimethylpent-4-yn-1-yl4-bromobenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15BrO3S
InChI InChI=1S/C13H15BrO3S/c1-4-9-13(2,3)10-17-18(15,16)12-7-5-11(14)6-8-12/h1,5-8H,9-10H2,2-3H3
InChIKey MCFGRVJSGCYKCZ-UHFFFAOYSA-N
Molecular Weight 331.224 g/mol
SMILES C(C(CC#C)(C)C)OS(c1ccc(cc1)Br)(=O)=O
SPLASH splash10-06fr-6490000000-c12c6566113903707e31
Source of Spectrum ACI-53-SMS47-S17
Synonyms 2,2-Dimethylpent-4-yn-1-yl 4-bromobenzenesulfonate
Wiley ID 1782129