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(3R,11aR)-3-Phenyl-1H,3H-pyrazino[2,3-e]thiazolo[3,4-a][1,4]diazepin-5,11(10H,11aH)-dione
SpectraBase Compound ID 8WTJIrfSuBS
InChI InChI=1S/C15H12N4O2S/c20-13-10-8-22-15(9-4-2-1-3-5-9)19(10)14(21)11-12(18-13)17-7-6-16-11/h1-7,10,15H,8H2,(H,17,18,20)/t10-,15+/m0/s1
InChIKey NIPVTMKEEQFHLF-ZUZCIYMTSA-N
Mol Weight 312.35 g/mol
Molecular Formula C15H12N4O2S
Exact Mass 312.068097 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1zKblYf0JCg
Name (3R,11aR)-3-Phenyl-1H,3H-pyrazino[2,3-e]thiazolo[3,4-a][1,4]diazepin-5,11(10H,11aH)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12N4O2S
InChI InChI=1S/C15H12N4O2S/c20-13-10-8-22-15(9-4-2-1-3-5-9)19(10)14(21)11-12(18-13)17-7-6-16-11/h1-7,10,15H,8H2,(H,17,18,20)/t10-,15+/m0/s1
InChIKey NIPVTMKEEQFHLF-ZUZCIYMTSA-N
Molecular Weight 312.347 g/mol
SMILES N1c2c(C(N3[C@](C1=O)(CS[C@@]3(c1ccccc1)[H])[H])=O)nccn2
SPLASH splash10-03di-0709000000-fb336e3952aad90c676b
Source of Spectrum F-54-5863-5
Synonyms (6aR,9R)-9-phenyl-6a,7-dihydro-6H-pyrazino[2,3-e][1,3]thiazolo[3,4-a][1,4]diazepine-6,11(5H)-dione
Wiley ID 807103