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1-Phenyl-1,2,4,5-tetrahydro-[1,2,4]triazolo[3,2-d]-[1,5]benzoxazepin-2-thione
SpectraBase Compound ID Bbvz5Srjwfc
InChI InChI=1S/C16H13N3OS/c21-16-17-15-10-11-20-14-9-5-4-8-13(14)19(15)18(16)12-6-2-1-3-7-12/h1-9H,10-11H2
InChIKey GAMDQRAHRARICI-UHFFFAOYSA-N
Mol Weight 295.36 g/mol
Molecular Formula C16H13N3OS
Exact Mass 295.077933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3cywiiavRG0
Name 1-Phenyl-1,2,4,5-tetrahydro-[1,2,4]triazolo[3,2-d]-[1,5]benzoxazepin-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13N3OS
InChI InChI=1S/C16H13N3OS/c21-16-17-15-10-11-20-14-9-5-4-8-13(14)19(15)18(16)12-6-2-1-3-7-12/h1-9H,10-11H2
InChIKey GAMDQRAHRARICI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.20040220316
Molecular Weight 295.360 g/mol
SMILES C1Oc2c(N3C(C1)=NC(N3c1ccccc1)=S)cccc2
SPLASH splash10-0002-3290000000-356fc49a1187cbbbe23d
Source of Spectrum CJC-22-294-7a
Synonyms 1-Phenyl-4,5-dihydrobenzo[b][1,2,4]triazolo[1,5-d][1,4]oxazepine-2(1H)-thione
Wiley ID 1773929