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Cyclopent[d][1,3]oxazine-1(2H)-carboxylic acid,hexahydro-5,6,7-tris(phenylmethoxy)-, phenyl ester, [4aR-(4a.alpha.,5.alpha.,6.beta.,7.alpha.,7a.alpha.)]-

View entire compound with spectra: 1 MS (GC)

Cyclopent[d][1,3]oxazine-1(2H)-carboxylic acid,hexahydro-5,6,7-tris(phenylmethoxy)-, phenyl ester, [4aR-(4a.alpha.,5.alpha.,6.beta.,7.alpha.,7a.alpha.)]-
SpectraBase Compound ID 9Jg4kA9SbEp
InChI InChI=1S/C29H35NO4/c1-30(2)26-25(18-31)27(32-19-22-12-6-3-7-13-22)29(34-21-24-16-10-5-11-17-24)28(26)33-20-23-14-8-4-9-15-23/h3-17,25-29,31H,18-21H2,1-2H3/t25-,26+,27+,28+,29+/m1/s1
InChIKey YAOFQOTVFVLJLD-QZLCNWOESA-N
Mol Weight 461.6 g/mol
Molecular Formula C29H35NO4
Exact Mass 461.256609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6JH34sU75nk
Name Cyclopent[d][1,3]oxazine-1(2H)-carboxylic acid,hexahydro-5,6,7-tris(phenylmethoxy)-, phenyl ester, [4aR-(4a.alpha.,5.alpha.,6.beta.,7.alpha.,7a.alpha.)]-
Alternate Name(s) (1L)-(1,2,4/3,5)-3,4,5-tri-O-benzyl-2-dimethylamino-1-hydroxymethyl-3,4,5-cyclpentantriol [(1S,2S,3S,4S,5S)-2,3,4-tris(benzyloxy)-5-(dimethylamino)cyclopentyl]methanol
CAS Registry Number 73135-46-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H35NO4
InChI InChI=1S/C29H35NO4/c1-30(2)26-25(18-31)27(32-19-22-12-6-3-7-13-22)29(34-21-24-16-10-5-11-17-24)28(26)33-20-23-14-8-4-9-15-23/h3-17,25-29,31H,18-21H2,1-2H3/t25-,26+,27+,28+,29+/m1/s1
InChIKey YAOFQOTVFVLJLD-QZLCNWOESA-N
Molecular Weight 461.602 g/mol
SMILES OC[C@]1([C@@]([C@](OCc2ccccc2)([C@]([C@]1(N(C)C)[H])(OCc1ccccc1)[H])[H])(OCc1ccccc1)[H])[H]
SPLASH splash10-0007-9201000000-9734761a03aca6df4434
Source of Spectrum H-62-2013-0
Wiley ID 1390838