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3-METHYL-2-BENZOTHIAZOLINONE, AZINE WITH FORMALDEHYDE
SpectraBase Compound ID BeJkIfoKhsu
InChI InChI=1S/C9H9N3S/c1-10-11-9-12(2)7-5-3-4-6-8(7)13-9/h3-6H,1H2,2H3/b11-9-
InChIKey MZWNQHHNKIXXDJ-LUAWRHEFSA-N
Mol Weight 191.25 g/mol
Molecular Formula C9H9N3S
Exact Mass 191.051718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CiamWh8WeUK
Name 3-METHYL-2-BENZOTHIAZOLINONE, AZINE WITH FORMALDEHYDE
Source of Sample M. Naulet, M. Leymarie, G. J. Martin Org. Magn. Resonance 11, 16 (1978)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9N3S
InChI InChI=1S/C9H9N3S/c1-10-11-9-12(2)7-5-3-4-6-8(7)13-9/h3-6H,1H2,2H3/b11-9-
InChIKey MZWNQHHNKIXXDJ-LUAWRHEFSA-N
Molecular Weight 191.26
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Varian XL-100
Synonyms 2-BENZOTHIAZOLINONE, 3-METHYL-, AZINE WITH FORMALDEHYDE FORMALDEHYDE, AZINE WITH 3-METHYL- 2-BENZOTHIAZOLINONE