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1H,3H-Pyrrolo[1,2-c]oxazol-1-one, 3-(1,1-dimethylethyl)tetrahydro-7a-[1,2,3,4-tetrahydro-2-oxo-1-(pheny lmethyl)-4-pyridinyl]-, [3R-[3.alpha.,7a.alpha.(R*)]]-
SpectraBase Compound ID JvauOYEZl8I
InChI InChI=1S/C22H28N2O3/c1-21(2,3)19-24-12-7-11-22(24,20(26)27-19)17-10-13-23(18(25)14-17)15-16-8-5-4-6-9-16/h4-6,8-10,13,17,19H,7,11-12,14-15H2,1-3H3/t17?,19-,22-/m1/s1
InChIKey LPQFKNVCQMXDTG-VUVKHWMNSA-N
Mol Weight 368.48 g/mol
Molecular Formula C22H28N2O3
Exact Mass 368.209993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7GmPxGoB6CP
Name 1H,3H-Pyrrolo[1,2-c]oxazol-1-one, 3-(1,1-dimethylethyl)tetrahydro-7a-[1,2,3,4-tetrahydro-2-oxo-1-(pheny lmethyl)-4-pyridinyl]-, [3R-[3.alpha.,7a.alpha.(R*)]]-
CAS Registry Number 86046-27-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28N2O3
InChI InChI=1S/C22H28N2O3/c1-21(2,3)19-24-12-7-11-22(24,20(26)27-19)17-10-13-23(18(25)14-17)15-16-8-5-4-6-9-16/h4-6,8-10,13,17,19H,7,11-12,14-15H2,1-3H3/t17?,19-,22-/m1/s1
InChIKey LPQFKNVCQMXDTG-VUVKHWMNSA-N
Molecular Weight 368.477 g/mol
SMILES [C@@]12(N([C@](OC2=O)(C(C)(C)C)[H])CCC1)C1C=CN(C(C1)=O)Cc1ccccc1
SPLASH splash10-001i-9000000000-c01d1415f722c1e5ba8c
Source of Spectrum C-105-5397-0
Synonyms (2R,5R)-5-(1'-benzyl-2'-oxo-1',2',3',4'-tetrahydro-4'-pyridyl)-2-tert-butyl-1-aza-3-oxabicyclo[3.3.0]octan-4-one (3R,7aR)-7a-(1-benzyl-2-oxo-1,2,3,4-tetrahydro-4-pyridinyl)-3-tert-butyltetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-1-one
Wiley ID 1353237