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1H-Isoindole-1,3(2H)-dione, hexahydro-2-(2-hydroxy-2-phenylethyl)-3a,7a-bis(phenylmethyl)-
SpectraBase Compound ID 9iIZn6OmOYF
InChI InChI=1S/C30H31NO3/c32-26(25-16-8-3-9-17-25)22-31-27(33)29(20-23-12-4-1-5-13-23)18-10-11-19-30(29,28(31)34)21-24-14-6-2-7-15-24/h1-9,12-17,26,32H,10-11,18-22H2
InChIKey OGFJABMQMFAKKF-UHFFFAOYSA-N
Mol Weight 453.58 g/mol
Molecular Formula C30H31NO3
Exact Mass 453.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F0wlvgmKsUt
Name 1H-Isoindole-1,3(2H)-dione, hexahydro-2-(2-hydroxy-2-phenylethyl)-3a,7a-bis(phenylmethyl)-
CAS Registry Number 64090-41-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H31NO3
InChI InChI=1S/C30H31NO3/c32-26(25-16-8-3-9-17-25)22-31-27(33)29(20-23-12-4-1-5-13-23)18-10-11-19-30(29,28(31)34)21-24-14-6-2-7-15-24/h1-9,12-17,26,32H,10-11,18-22H2
InChIKey OGFJABMQMFAKKF-UHFFFAOYSA-N
Molecular Weight 453.582 g/mol
SMILES OC(CN1C(C2(Cc3ccccc3)CCCCC2(C1=O)Cc1ccccc1)=O)c1ccccc1
SPLASH splash10-052f-9432000000-8b308b141764ab94409d
Source of Spectrum H-60-1469-0
Synonyms 3a,7a-dibenzyl-2-(2-hydroxy-2-phenylethyl)hexahydro-1H-isoindole-1,3(2H)-dione cis-1,2-dibenzyl-N-((2-hydroxy-2-phenyl)-ethyl)-cyclohexane-1,2-dicarboximide
Wiley ID 1388554