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Ethyl (2RS,3aSR,8bRS)-2,3,3a,4,6,8b-Hexahydro-6-phenyl-1,8-dimethyl-1H-pyrrolo[2',3':4,5]thiopyrano[2,3-c]]pyrazole-2-carboxylate

View entire compound with spectra: 1 MS (GC)

Ethyl (2RS,3aSR,8bRS)-2,3,3a,4,6,8b-Hexahydro-6-phenyl-1,8-dimethyl-1H-pyrrolo[2',3':4,5]thiopyrano[2,3-c]]pyrazole-2-carboxylate
SpectraBase Compound ID 31VEtua6yJI
InChI InChI=1S/C19H23N3O2S/c1-4-16(23)24-15-10-13-11-25-19-17(18(13)21(15)3)12(2)20-22(19)14-8-6-5-7-9-14/h5-9,13,15,18H,4,10-11H2,1-3H3/t13-,15+,18-/m1/s1
InChIKey IPYQZMWODSCLIW-QIIPPGSGSA-N
Mol Weight 357.47 g/mol
Molecular Formula C19H23N3O2S
Exact Mass 357.151098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DuiGluaRGmJ
Name Ethyl (2RS,3aSR,8bRS)-2,3,3a,4,6,8b-Hexahydro-6-phenyl-1,8-dimethyl-1H-pyrrolo[2',3':4,5]thiopyrano[2,3-c]]pyrazole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23N3O2S
InChI InChI=1S/C19H23N3O2S/c1-4-16(23)24-15-10-13-11-25-19-17(18(13)21(15)3)12(2)20-22(19)14-8-6-5-7-9-14/h5-9,13,15,18H,4,10-11H2,1-3H3/t13-,15+,18-/m1/s1
InChIKey IPYQZMWODSCLIW-QIIPPGSGSA-N
Molecular Weight 357.472 g/mol
SMILES c12c([n](-c3ccccc3)nc1C)SC[C@@]1([C@]2(N([C@@](OC(=O)CC)(C1)[H])C)[H])[H]
SPLASH splash10-001i-0090000000-1f8eb518ac3bac537335
Source of Spectrum KC-0-2555-20
Wiley ID 782144