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5-Methyl-2-[2-(4-methylisochroman-4-ylmethyl)allyl]-4-phenyl-1,3,3a.alpha.,4.alpha.,6.alpha.,.beta.,6a.alpha.-hexahydropyrrolo[3,4-c]pyrrole-1,3-dione

View entire compound with spectra: 2 MS (GC)

5-Methyl-2-[2-(4-methylisochroman-4-ylmethyl)allyl]-4-phenyl-1,3,3a.alpha.,4.alpha.,6.alpha.,.beta.,6a.alpha.-hexahydropyrrolo[3,4-c]pyrrole-1,3-dione
SpectraBase Compound ID HMW83K1x5B5
InChI InChI=1S/C27H30N2O3/c1-18(13-27(2)17-32-16-20-11-7-8-12-22(20)27)14-29-25(30)21-15-28(3)24(23(21)26(29)31)19-9-5-4-6-10-19/h4-12,21,23-24H,1,13-17H2,2-3H3/t21-,23-,24-,27?/m0/s1
InChIKey YKDRMUYPZNXYDC-AAJVBWRUSA-N
Mol Weight 430.55 g/mol
Molecular Formula C27H30N2O3
Exact Mass 430.225643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AJWxRtgFFfo
Name 5-Methyl-2-[2-(4-methylisochroman-4-ylmethyl)allyl]-4-phenyl-1,3,3a.alpha.,4.alpha.,6.alpha.,.beta.,6a.alpha.-hexahydropyrrolo[3,4-c]pyrrole-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H30N2O3
InChI InChI=1S/C27H30N2O3/c1-18(13-27(2)17-32-16-20-11-7-8-12-22(20)27)14-29-25(30)21-15-28(3)24(23(21)26(29)31)19-9-5-4-6-10-19/h4-12,21,23-24H,1,13-17H2,2-3H3/t21-,23-,24-,27?/m0/s1
InChIKey YKDRMUYPZNXYDC-AAJVBWRUSA-N
Molecular Weight 430.548 g/mol
SMILES C1(N(C([C@]2(CN([C@]([C@@]12[H])(c1ccccc1)[H])C)[H])=O)CC(CC1(c2c(cccc2)COC1)C)=C)=O
SPLASH splash10-00ls-1950200000-091e52beca4b67750bd5
Source of Spectrum KC-57-7987-14
Synonyms 5-Methyl-2-[2-(4-methylisochroman-4-ylmethyl)allyl]-4-phenyl-1,3,3a.alpha.,4.beta.,6.alpha.,.beta.,6a.alpha.-hexahydropyrrolo[3,4-c]pyrrole-1,3-dione
Wiley ID 1625875