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2-But-3-ynoxysulfonylbenzoic acid methyl ester
SpectraBase Compound ID InZe8akaQxr
InChI InChI=1S/C12H12O5S/c1-3-4-9-17-18(14,15)11-8-6-5-7-10(11)12(13)16-2/h1,5-8H,4,9H2,2H3
InChIKey CWQGWNFOAMTRPT-UHFFFAOYSA-N
Mol Weight 268.28 g/mol
Molecular Formula C12H12O5S
Exact Mass 268.040545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F5t8dOq8Jrm
Name 2-But-3-ynoxysulfonylbenzoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O5S
InChI InChI=1S/C12H12O5S/c1-3-4-9-17-18(14,15)11-8-6-5-7-10(11)12(13)16-2/h1,5-8H,4,9H2,2H3
InChIKey CWQGWNFOAMTRPT-UHFFFAOYSA-N
Molecular Weight 268.283 g/mol
SMILES c1(S(=O)(=O)OCCC#C)c(C(=O)OC)cccc1
SPLASH splash10-0002-2900000000-dcbedb2bb130c02a9918
Source of Spectrum H1-46-527-1
Synonyms Methyl 2-but-3-ynoxysulfonylbenzoate
Wiley ID 816020