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1H-Isoindole-1,3(2H)-dione, 4-(benzoyloxy)-7-[(benzoyloxy)methyl]-3a,4,7,7a-tetrahydro-2-phenyl-
SpectraBase Compound ID 6lj3MVIUd8F
InChI InChI=1S/C29H23NO6/c31-26-24-21(18-35-28(33)19-10-4-1-5-11-19)16-17-23(36-29(34)20-12-6-2-7-13-20)25(24)27(32)30(26)22-14-8-3-9-15-22/h1-17,21,23-25H,18H2
InChIKey YDWQYLRPNRIJOQ-UHFFFAOYSA-N
Mol Weight 481.5 g/mol
Molecular Formula C29H23NO6
Exact Mass 481.152537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 950Mfxth0mh
Name 1H-Isoindole-1,3(2H)-dione, 4-(benzoyloxy)-7-[(benzoyloxy)methyl]-3a,4,7,7a-tetrahydro-2-phenyl-
Alternate Name(s) 4-[(benzoyloxy)methyl]-7-(benzoyloxy)-3a,4,7,7a-tetrahydro-2-phenyl-1,3-isoindoledione 7-[(benzoyloxy)methyl]-1,3-dioxo-2-phenyl-2,3,3a,4,7,7a-hexahydro-1H-isoindol-4-yl benzoate
CAS Registry Number 114133-17-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H23NO6
InChI InChI=1S/C29H23NO6/c31-26-24-21(18-35-28(33)19-10-4-1-5-11-19)16-17-23(36-29(34)20-12-6-2-7-13-20)25(24)27(32)30(26)22-14-8-3-9-15-22/h1-17,21,23-25H,18H2
InChIKey YDWQYLRPNRIJOQ-UHFFFAOYSA-N
Molecular Weight 481.504 g/mol
SMILES C1(N(C(C2C(C=CC(C12)OC(=O)c1ccccc1)COC(=O)c1ccccc1)=O)c1ccccc1)=O
SPLASH splash10-0ab9-0900000000-a71560a217564859ff4b
Source of Spectrum J-53-1870-36
Wiley ID 1395431