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2-[2-(4-Methylisochroman-4-ylmethyl)allyl]-4-phenyl-1,2,3,3a.alpha.,4.beta.,6,7,8,8a.alpha.,8b.alpha.-decahydropyrrolo[3,4-a]pyrrolizine-1,3-dione
SpectraBase Compound ID JCtQQEi7JMn
InChI InChI=1S/C29H32N2O3/c1-19(15-29(2)18-34-17-21-11-6-7-12-22(21)29)16-31-27(32)24-23-13-8-14-30(23)26(25(24)28(31)33)20-9-4-3-5-10-20/h3-7,9-12,23-26H,1,8,13-18H2,2H3/t23-,24+,25+,26-,29?/m1/s1
InChIKey YKKBYBMWGMAKPB-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 3mGNm0FrOK
Name 2-[2-(4-Methylisochroman-4-ylmethyl)allyl]-4-phenyl-1,2,3,3a.alpha.,4.beta.,6,7,8,8a.alpha.,8b.alpha.-decahydropyrrolo[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(15-29(2)18-34-17-21-11-6-7-12-22(21)29)16-31-27(32)24-23-13-8-14-30(23)26(25(24)28(31)33)20-9-4-3-5-10-20/h3-7,9-12,23-26H,1,8,13-18H2,2H3/t23-,24+,25+,26-,29?/m1/s1
InChIKey YKKBYBMWGMAKPB-AKGLAACZSA-N
Molecular Weight 456.586 g/mol
SMILES C1(N(C([C@@]2([C@](N3CCC[C@@]3([C@]12[H])[H])(c1ccccc1)[H])[H])=O)CC(CC1(c2c(cccc2)COC1)C)=C)=O
SPLASH splash10-0a4i-2905100000-8ebf151a9fc8fd57e118
Source of Spectrum KC-57-7988-31
Wiley ID 1625866