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(1.alpha.,4.alpha.,5.alpha.)-4-Ethoxy-2,4-diphenyl-7-oxa-3-azabicyclo[3.3.1]non-2-en-9-one
SpectraBase Compound ID HatbtjZ5z3P
InChI InChI=1S/C21H21NO3/c1-2-25-21(16-11-7-4-8-12-16)18-14-24-13-17(20(18)23)19(22-21)15-9-5-3-6-10-15/h3-12,17-18H,2,13-14H2,1H3/t17-,18-,21-/m1/s1
InChIKey YBPHQJRNOPGZHJ-DBXWQHBBSA-N
Mol Weight 335.4 g/mol
Molecular Formula C21H21NO3
Exact Mass 335.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7afiFxB4Hzv
Name (1.alpha.,4.alpha.,5.alpha.)-4-Ethoxy-2,4-diphenyl-7-oxa-3-azabicyclo[3.3.1]non-2-en-9-one
Alternate Name(s) (1S,5S,8S)-8-ethoxy-6,8-diphenyl-3-oxa-7-azabicyclo[3.3.1]non-6-en-9-one
CAS Registry Number 143143-47-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO3
InChI InChI=1S/C21H21NO3/c1-2-25-21(16-11-7-4-8-12-16)18-14-24-13-17(20(18)23)19(22-21)15-9-5-3-6-10-15/h3-12,17-18H,2,13-14H2,1H3/t17-,18-,21-/m1/s1
InChIKey YBPHQJRNOPGZHJ-DBXWQHBBSA-N
Molecular Weight 335.403 g/mol
SMILES [C@@]1(N=C(c2ccccc2)[C@@]2(C([C@]1(COC2)[H])=O)[H])(c1ccccc1)OCC
SPLASH splash10-0a4r-0419000000-ea675fb36b7b79f8db27
Source of Spectrum K-126-140-10
Wiley ID 1331815