(1R,3S,8aS)-1-methyl-3-phenyl-7-(phenylmethyl)-5-sulfanylidene-1,3,6,8a-tetrahydro-[1,3]oxazolo[3,4-a]pyrazin-8-one

SpectraBase Compound ID	DZTHvCWWVrd
InChI	InChI=1S/C20H20N2O2S/c1-14-18-19(23)21(12-15-8-4-2-5-9-15)13-17(25)22(18)20(24-14)16-10-6-3-7-11-16/h2-11,14,18,20H,12-13H2,1H3/t14-,18+,20+/m1/s1
InChIKey	AEVXECFQHVFYPC-WNYOCNMUSA-N Google Search
Mol Weight	352.45 g/mol
Molecular Formula	C20H20N2O2S
Exact Mass	352.124549 g/mol

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SpectraBase Spectrum ID	7JQp6cdnVKs
Name	(1R,3S,8aS)-1-methyl-3-phenyl-7-(phenylmethyl)-5-sulfanylidene-1,3,6,8a-tetrahydro-[1,3]oxazolo[3,4-a]pyrazin-8-one
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H20N2O2S
InChI	InChI=1S/C20H20N2O2S/c1-14-18-19(23)21(12-15-8-4-2-5-9-15)13-17(25)22(18)20(24-14)16-10-6-3-7-11-16/h2-11,14,18,20H,12-13H2,1H3/t14-,18+,20+/m1/s1
InChIKey	AEVXECFQHVFYPC-WNYOCNMUSA-N
Molecular Weight	352.452 g/mol
SMILES	[C@]12(C(N(CC(N2[C@@](O[C@@]1(C)[H])(c1ccccc1)[H])=S)Cc1ccccc1)=O)[H]
SPLASH	splash10-0f79-0009000000-7b2680793ca5203dfda5
Source of Spectrum	KC-57-4362-7
Synonyms	(1R,3S,8aS)-1-methyl-3-phenyl-7-(phenylmethyl)-5-sulfanylidene-1,3,6,8a-tetrahydrooxazolo[3,4-a]pyrazin-8-one (1R,3S,8aS)-7-benzyl-1-methyl-3-phenyl-5-sulfanylidene-1,3,6,8a-tetrahydro-[1,3]oxazolo[3,4-a]pyrazin-8-one (1R,3S,8aS)-7-benzyl-1-methyl-3-phenyl-5-thioxo-1,3,6,8a-tetrahydrooxazolo[3,4-a]pyrazin-8-one
Wiley ID	1624112