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(4-hydroxybenzoyl)(4,5,6,7-tetrahydrobenzo[d]isothiazol-2-ium-2-yl)amide
SpectraBase Compound ID DGpsCqtWWe2
InChI InChI=1S/C14H14N2O2S/c17-12-7-5-10(6-8-12)14(18)15-16-9-11-3-1-2-4-13(11)19-16/h5-9,17H,1-4H2
InChIKey XOHUJAAMZQXRHU-UHFFFAOYSA-N
Mol Weight 274.34 g/mol
Molecular Formula C14H14N2O2S
Exact Mass 274.077599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FmZzPDzj40i
Name (4-hydroxybenzoyl)(4,5,6,7-tetrahydrobenzo[d]isothiazol-2-ium-2-yl)amide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O2S
InChI InChI=1S/C14H14N2O2S/c17-12-7-5-10(6-8-12)14(18)15-16-9-11-3-1-2-4-13(11)19-16/h5-9,17H,1-4H2
InChIKey XOHUJAAMZQXRHU-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19943360204
Molecular Weight 274.338 g/mol
SMILES Oc1ccc(C([N-][n+]2cc3c(s2)CCCC3)=O)cc1
SPLASH splash10-00di-0910000000-17a1d8bed87bd7819960
Source of Spectrum JF-336-119-4l
Wiley ID 1789874