For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

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

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID CDCEkYEddFk
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
Comments Tentative assignment
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
Melting Point 259-261C
Molecular Weight 295.36
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms BENZENONAPHTH/2,3-D/ISOTHIAZOLIN- 3-ONE, 4,9-O-, 3A,4,9,9A-TETRAHYDRO-, 1-OXIDE