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3a,4,9,9a-tetrahydro-4,9-o-benzenonaphth[2,3-d]isothiazolin-3-one, 1-oxide

View entire compound with spectra: 2 NMR, and 1 FTIR

3a,4,9,9a-tetrahydro-4,9-o-benzenonaphth[2,3-d]isothiazolin-3-one, 1-oxide
SpectraBase Compound ID FnJOSZvJNoe
InChI InChI=1S/C17H13NO2S/c19-17-15-13-9-5-1-3-7-11(9)14(16(15)21(20)18-17)12-8-4-2-6-10(12)13/h1-8,13-16H,(H,18,19)
InChIKey MEELPJGMBPQTCI-UHFFFAOYSA-N
Mol Weight 295.36 g/mol
Molecular Formula C17H13NO2S
Exact Mass 295.0667 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID H1zMm6QQwEm
Name 3a,4,9,9a-TETRAHYDRO-4,9-o-BENZENONAPHTH[2,3-d]ISOTHIAZOLIN-3-ONE, 1-OXIDE
Source of Sample E. D. WEILER, ROHM AND HAAS COMPANY, BRISTOL, PENNSYLVANIA
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13NO2S
InChI InChI=1S/C17H13NO2S/c19-17-15-13-9-5-1-3-7-11(9)14(16(15)21(20)18-17)12-8-4-2-6-10(12)13/h1-8,13-16H,(H,18,19)
InChIKey MEELPJGMBPQTCI-UHFFFAOYSA-N
Literature Reference J. HETEROCYCLIC CHEM. 15, 1299(1978) Abstract-Chemical Abstracts= 90, 137720(1979)
Melting Point 259-261C
Molecular Weight 295.355988
Synonyms BENZENONAPHTH/2,3-D/ISOTHIAZOLIN- 3-ONE, 4,9-O-, 3A,4,9,9A-TETRAHYDRO-, 1-OXIDE
Technique KBr WAFER