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Thieno[3,2-d]isothiazol-4(5H)-one, 3-phenyl-
SpectraBase Compound ID BBIpMqwetSE
InChI InChI=1S/C11H7NOS2/c13-8-6-14-11-9(8)10(12-15-11)7-4-2-1-3-5-7/h1-5H,6H2
InChIKey IWVOSXXOKLWZRL-UHFFFAOYSA-N
Mol Weight 233.3 g/mol
Molecular Formula C11H7NOS2
Exact Mass 232.996906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 90nql15DZ6j
Name Thieno[3,2-d]isothiazol-4(5H)-one, 3-phenyl-
Alternate Name(s) 3-Phenylthieno[3,2-d]isothiazol-4(5H)-one
CAS Registry Number 126938-88-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H7NOS2
InChI InChI=1S/C11H7NOS2/c13-8-6-14-11-9(8)10(12-15-11)7-4-2-1-3-5-7/h1-5H,6H2
InChIKey IWVOSXXOKLWZRL-UHFFFAOYSA-N
Molecular Weight 233.303 g/mol
SMILES c12c(snc2-c2ccccc2)SCC1=O
SPLASH splash10-0frx-9230000000-0eea6064bceaf0cc5c1d
Source of Spectrum B-42-1301-3
Wiley ID 1234689