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(7R,8S)-2,6-Dihexyl-7,8-dimethyl-7,8-dihydroazepino[3,4-f]isoindole-1,3,5,9(2H,6H)-tetraone

View entire compound with spectra: 1 MS (GC)

(7R,8S)-2,6-Dihexyl-7,8-dimethyl-7,8-dihydroazepino[3,4-f]isoindole-1,3,5,9(2H,6H)-tetraone
SpectraBase Compound ID H6MGFkPbP6f
InChI InChI=1S/C26H36N2O4/c1-5-7-9-11-13-27-18(4)17(3)23(29)19-15-21-22(16-20(19)24(27)30)26(32)28(25(21)31)14-12-10-8-6-2/h15-18H,5-14H2,1-4H3/t17-,18+/m0/s1
InChIKey PSJIPRVQBXOWML-ZWKOTPCHSA-N
Mol Weight 440.6 g/mol
Molecular Formula C26H36N2O4
Exact Mass 440.267508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3TSFRNNtCa
Name (7R,8S)-2,6-Dihexyl-7,8-dimethyl-7,8-dihydroazepino[3,4-f]isoindole-1,3,5,9(2H,6H)-tetraone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H36N2O4
InChI InChI=1S/C26H36N2O4/c1-5-7-9-11-13-27-18(4)17(3)23(29)19-15-21-22(16-20(19)24(27)30)26(32)28(25(21)31)14-12-10-8-6-2/h15-18H,5-14H2,1-4H3/t17-,18+/m0/s1
InChIKey PSJIPRVQBXOWML-ZWKOTPCHSA-N
Molecular Weight 440.584 g/mol
SMILES C1(N(C(c2cc3C(N([C@@]([C@@](C(c3cc12)=O)(C)[H])(C)[H])CCCCCC)=O)=O)CCCCCC)=O
SPLASH splash10-0btc-9400000000-9bc2b4a6c91a36232bf9
Source of Spectrum AJ-65-2877-14
Synonyms (7R,8S)-2,6-dihexyl-7,8-dimethyl-7,8-dihydroazepino[3,4-f]isoindole-1,3,5,9(2H,6H)-tetrone 2,6-Dihexyl-cis-7,8-dimethyl-7,8-dihydroazepino[3,4-f]isoindole-1,3,5,9(2H,6H)-tetraone
Wiley ID 771824