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7-METHOXY-2,3,4,5-TETRAHYDRO-1,4-BENZOTHIAZEPINE

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7-METHOXY-2,3,4,5-TETRAHYDRO-1,4-BENZOTHIAZEPINE
SpectraBase Compound ID 6lgEFUjNu
InChI InChI=1S/C10H13NOS/c1-12-9-2-3-10-8(6-9)7-11-4-5-13-10/h2-3,6,11H,4-5,7H2,1H3
InChIKey VXSSDKLUAZVADY-UHFFFAOYSA-N
Mol Weight 195.28 g/mol
Molecular Formula C10H13NOS
Exact Mass 195.071785 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9zpiTDYuA3p
Name 7-METHOXY-2,3,4,5-TETRAHYDRO-1,4-BENZOTHIAZEPINE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H13NOS
InChI InChI=1S/C10H13NOS/c1-12-9-2-3-10-8(6-9)7-11-4-5-13-10/h2-3,6,11H,4-5,7H2,1H3
InChIKey VXSSDKLUAZVADY-UHFFFAOYSA-N
Literature Reference Author M.THEVIS,S.BEUCK,A.THOMAS,M.KOHLER,N.SCHLOERER,I.VAJIALA,W.S CHAENZER
Literature Reference Citation DRUG.TEST.ANAL.,1,32(2009)
Literature Reference DOI 10.1002/dta.13
Molecular Weight 195.279 g/mol
Sample ID 72203
Solvent CDCl3