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(4S,7R,8R,8aS)-4,7,8-Triphenyl-hexahydro-pyrrolo[2,1-c][1,4]oxazin-1-one

View entire compound with spectra: 1 MS (GC)

(4S,7R,8R,8aS)-4,7,8-Triphenyl-hexahydro-pyrrolo[2,1-c][1,4]oxazin-1-one
SpectraBase Compound ID 7IKeuRKAcc2
InChI InChI=1S/C25H23NO2/c27-25-24-23(20-14-8-3-9-15-20)21(18-10-4-1-5-11-18)16-26(24)22(17-28-25)19-12-6-2-7-13-19/h1-15,21-24H,16-17H2/t21-,22+,23-,24-/m0/s1
InChIKey TWXHOORGLXKBCG-KIHHCIJBSA-N
Mol Weight 369.46 g/mol
Molecular Formula C25H23NO2
Exact Mass 369.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7FKpcxkQVGu
Name (4S,7R,8R,8aS)-4,7,8-Triphenyl-hexahydro-pyrrolo[2,1-c][1,4]oxazin-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H23NO2
InChI InChI=1S/C25H23NO2/c27-25-24-23(20-14-8-3-9-15-20)21(18-10-4-1-5-11-18)16-26(24)22(17-28-25)19-12-6-2-7-13-19/h1-15,21-24H,16-17H2/t21-,22+,23-,24-/m0/s1
InChIKey TWXHOORGLXKBCG-KIHHCIJBSA-N
Molecular Weight 369.464 g/mol
SMILES [C@]12(N(C[C@]([C@@]2(c2ccccc2)[H])(c2ccccc2)[H])[C@](COC1=O)(c1ccccc1)[H])[H]
SPLASH splash10-0udi-0910000000-1d07dbe68f0f334164ff
Source of Spectrum D1-1994-928-9
Synonyms (2S,7R,6R,8R)-5-Oxo-5,7,8-triphenyl-1-aza-4-oxabicyclo[4.3.0(1,6)]nonane (4S,7R,8R,8aS)-4,7,8-triphenylhexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-1-one 5-Oxo-5,7,8-triphenyl-1-aza-4-oxabicyclo[4.3.0(1,6)]nonane
Wiley ID 834533