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2-[2-(1-Methyl-1,3-dihydro-isobenzofuran-1-ylmethyl)allyl]-8-phenyl-1,2,3,3a.alpha.,4.beta.,6,7,8,9,9a.alpha.,9b.alpha.-decahydro-1H-pyrrolo[3,4-a]pyrrolizine-1,3-dione
SpectraBase Compound ID qmfgkjtGHG
InChI InChI=1S/C29H32N2O3/c1-19(16-29(2)22-13-7-6-12-21(22)18-34-29)17-31-27(32)24-23-14-8-9-15-30(23)26(25(24)28(31)33)20-10-4-3-5-11-20/h3-7,10-13,23-26H,1,8-9,14-18H2,2H3/t23-,24+,25+,26-,29?/m1/s1
InChIKey MZQVUBKMIZEYTA-AKGLAACZSA-N
Mol Weight 456.6 g/mol
Molecular Formula C29H32N2O3
Exact Mass 456.241293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FsoXJzLBMG2
Name 2-[2-(1-Methyl-1,3-dihydro-isobenzofuran-1-ylmethyl)allyl]-8-phenyl-1,2,3,3a.alpha.,4.beta.,6,7,8,9,9a.alpha.,9b.alpha.-decahydro-1H-pyrrolo[3,4-a]pyrrolizine-1,3-dione
Alternate Name(s) 2-[2-(1-Methyl-1,3-dihydroisobenzofuran-1-ylmethyl)allyl]-8-phenyl-1,2,3,3a.alpha.,4.beta.,6,7,8,9,9a.alpha.,9b.alpha.-decahydro-1H-pyrrolo[3,4-a]pyrrolizine-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H32N2O3
InChI InChI=1S/C29H32N2O3/c1-19(16-29(2)22-13-7-6-12-21(22)18-34-29)17-31-27(32)24-23-14-8-9-15-30(23)26(25(24)28(31)33)20-10-4-3-5-11-20/h3-7,10-13,23-26H,1,8-9,14-18H2,2H3/t23-,24+,25+,26-,29?/m1/s1
InChIKey MZQVUBKMIZEYTA-AKGLAACZSA-N
Molecular Weight 456.586 g/mol
SMILES C1(N(C([C@@]2([C@](N3CCCC[C@@]3([C@]12[H])[H])(c1ccccc1)[H])[H])=O)CC(CC1(OCc2c1cccc2)C)=C)=O
SPLASH splash10-0089-0902000000-fee6a29864a928a6bad8
Source of Spectrum KC-57-7989-31
Wiley ID 1625865