For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-[(4aR,7aS)-3-(4-methoxyphenyl)-6-phenyl-4a,7a-dihydro-2H-thiazolo[4,5-e][1,2,4]triazin-1-yl]ethanone
SpectraBase Compound ID BC2aX1f38Mr
InChI InChI=1S/C19H18N4O2S/c1-12(24)23-19-17(21-18(26-19)14-6-4-3-5-7-14)20-16(22-23)13-8-10-15(25-2)11-9-13/h3-11,17,19H,1-2H3,(H,20,22)/t17-,19+/m1/s1
InChIKey JANREZZQADPRIT-MJGOQNOKSA-N
Mol Weight 366.44 g/mol
Molecular Formula C19H18N4O2S
Exact Mass 366.115047 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2pEAOvTAVgh
Name 1-[(4aR,7aS)-3-(4-methoxyphenyl)-6-phenyl-4a,7a-dihydro-2H-thiazolo[4,5-e][1,2,4]triazin-1-yl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18N4O2S
InChI InChI=1S/C19H18N4O2S/c1-12(24)23-19-17(21-18(26-19)14-6-4-3-5-7-14)20-16(22-23)13-8-10-15(25-2)11-9-13/h3-11,17,19H,1-2H3,(H,20,22)/t17-,19+/m1/s1
InChIKey JANREZZQADPRIT-MJGOQNOKSA-N
Molecular Weight 366.439 g/mol
SMILES N1C(=NN([C@@]2([C@]1(N=C(S2)c1ccccc1)[H])[H])C(=O)C)c1ccc(cc1)OC
SPLASH splash10-01c0-0935000000-70525e9f9e95ec05712d
Source of Spectrum AH-2002-29-3
Synonyms 1-[(4aR,7aS)-3-(4-methoxyphenyl)-6-phenyl-4a,7a-dihydro-2H-[1,3]thiazolo[4,5-e][1,2,4]triazin-1-yl]ethanone
Wiley ID 1546537