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4-METHYL-7-METHOXY-2,3,4,5-TETRAHYDRO-1,4-BENZOTHIAZEPINE;S-107

View entire compound with spectra: 1 NMR, and 2 MS (GC)

4-METHYL-7-METHOXY-2,3,4,5-TETRAHYDRO-1,4-BENZOTHIAZEPINE;S-107
SpectraBase Compound ID 75LI5GsAtsf
InChI InChI=1S/C11H15NOS/c1-12-5-6-14-11-4-3-10(13-2)7-9(11)8-12/h3-4,7H,5-6,8H2,1-2H3
InChIKey BGVCEGVSQDOGSB-UHFFFAOYSA-N
Mol Weight 209.31 g/mol
Molecular Formula C11H15NOS
Exact Mass 209.087435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A4X5PxUfJaJ
Name 7-Methoxy-4-methyl-2,3,4,5-tetrahydrobenzo[f][1,4]thiazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15NOS
InChI InChI=1S/C11H15NOS/c1-12-5-6-14-11-4-3-10(13-2)7-9(11)8-12/h3-4,7H,5-6,8H2,1-2H3
InChIKey BGVCEGVSQDOGSB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/rcm.4161
Molecular Weight 209.307 g/mol
SMILES c12c(SCCN(C2)C)ccc(c1)OC
SPLASH splash10-0kai-2910000000-01b41e07a83be494930a
Source of Spectrum RCM-23-2366-1,S_107
Wiley ID 1820633