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5-Methyl-2-[2-(3-methyl-2,3-dihydrobenzofuran-3-ylmethyl)allyl]-4-phenyl-1,3,3a.alpha.,4.beta.,6.alpha.,.beta.,6a.alpha.-hexahydropyrrolo[3,4-c]pyrrole-1,3-dione
SpectraBase Compound ID HNngXLMrR3D
InChI InChI=1S/C26H28N2O3/c1-17(13-26(2)16-31-21-12-8-7-11-20(21)26)14-28-24(29)19-15-27(3)23(22(19)25(28)30)18-9-5-4-6-10-18/h4-12,19,22-23H,1,13-16H2,2-3H3/t19-,22-,23+,26?/m0/s1
InChIKey HGQHGZJTAOISJS-MAOXOFKSSA-N
Mol Weight 416.52 g/mol
Molecular Formula C26H28N2O3
Exact Mass 416.209993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CTHa8nSgZtc
Name 5-Methyl-2-[2-(3-methyl-2,3-dihydrobenzofuran-3-ylmethyl)allyl]-4-phenyl-1,3,3a.alpha.,4.beta.,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 C26H28N2O3
InChI InChI=1S/C26H28N2O3/c1-17(13-26(2)16-31-21-12-8-7-11-20(21)26)14-28-24(29)19-15-27(3)23(22(19)25(28)30)18-9-5-4-6-10-18/h4-12,19,22-23H,1,13-16H2,2-3H3/t19-,22-,23+,26?/m0/s1
InChIKey HGQHGZJTAOISJS-MAOXOFKSSA-N
Molecular Weight 416.521 g/mol
SMILES C1(N(C([C@]2(CN([C@@]([C@@]12[H])(c1ccccc1)[H])C)[H])=O)CC(CC1(c2c(cccc2)OC1)C)=C)=O
SPLASH splash10-053r-1920000000-de8a73caefc5c15ece97
Source of Spectrum KC-57-7986-11
Wiley ID 1625878