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(4-chlorobenzoyl)(4,5,6,7-tetrahydrobenzo[d]isothiazol-2-ium-2-yl)amide
SpectraBase Compound ID gYAPw5kRnl
InChI InChI=1S/C14H13ClN2OS/c15-12-7-5-10(6-8-12)14(18)16-17-9-11-3-1-2-4-13(11)19-17/h5-9H,1-4H2
InChIKey GGUOLWJIQDARSI-UHFFFAOYSA-N
Mol Weight 292.78 g/mol
Molecular Formula C14H13ClN2OS
Exact Mass 292.043712 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LrQ7e3cKOMC
Name (4-chlorobenzoyl)(4,5,6,7-tetrahydrobenzo[d]isothiazol-2-ium-2-yl)amide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13ClN2OS
InChI InChI=1S/C14H13ClN2OS/c15-12-7-5-10(6-8-12)14(18)16-17-9-11-3-1-2-4-13(11)19-17/h5-9H,1-4H2
InChIKey GGUOLWJIQDARSI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19943360204
Molecular Weight 292.784 g/mol
SMILES c12c[n+](sc2CCCC1)[N-]C(=O)c1ccc(cc1)Cl
SPLASH splash10-000i-0920000000-a27058988e294d72aa06
Source of Spectrum JF-336-119-4m
Wiley ID 1789875