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(3aS,4S,6S,6aR)-(+)-5-[(4S',5S')-2',2'-dimethyl-4'-phenyl-1',3'-dioxan-5'-yl]-2,4,6-triphenylperhydro-pyrrolo[3,4-c]pyrrole-1,3-dione

View entire compound with spectra: 1 MS (GC)

(3aS,4S,6S,6aR)-(+)-5-[(4S',5S')-2',2'-dimethyl-4'-phenyl-1',3'-dioxan-5'-yl]-2,4,6-triphenylperhydro-pyrrolo[3,4-c]pyrrole-1,3-dione
SpectraBase Compound ID F0gII8LRze5
InChI InChI=1S/C36H34N2O4/c1-36(2)41-23-28(33(42-36)26-19-11-5-12-20-26)38-31(24-15-7-3-8-16-24)29-30(32(38)25-17-9-4-10-18-25)35(40)37(34(29)39)27-21-13-6-14-22-27/h3-22,28-33H,23H2,1-2H3/t28-,29-,30+,31+,32+,33-/m0/s1
InChIKey BPLDIRIFVDIRMG-DWAULPMBSA-N
Mol Weight 558.7 g/mol
Molecular Formula C36H34N2O4
Exact Mass 558.251858 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5El1ZfmF4FN
Name (3aS,4S,6S,6aR)-(+)-5-[(4S',5S')-2',2'-dimethyl-4'-phenyl-1',3'-dioxan-5'-yl]-2,4,6-triphenylperhydro-pyrrolo[3,4-c]pyrrole-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H34N2O4
InChI InChI=1S/C36H34N2O4/c1-36(2)41-23-28(33(42-36)26-19-11-5-12-20-26)38-31(24-15-7-3-8-16-24)29-30(32(38)25-17-9-4-10-18-25)35(40)37(34(29)39)27-21-13-6-14-22-27/h3-22,28-33H,23H2,1-2H3/t28-,29-,30+,31+,32+,33-/m0/s1
InChIKey BPLDIRIFVDIRMG-DWAULPMBSA-N
Molecular Weight 558.678 g/mol
SMILES [C@]12([C@](C(=O)N(C2=O)c2ccccc2)([C@@](c2ccccc2)(N([C@@]1(c1ccccc1)[H])[C@@]1([C@@](OC(OC1)(C)C)(c1ccccc1)[H])[H])[H])[H])[H]
SPLASH splash10-0006-9000000000-d0780309e603b9790448
Source of Spectrum F-54-10748-5
Synonyms (3aR,4S,6S,6aS)-5-[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-2,4,6-triphenyltetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
Wiley ID 808653