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4-(4-CHLOROPHENYL)-1,3-DIOXO-2-PHENYL-3A,4,11A,11B-TETRAHYDROPYRROLO-[3,4-C]-XANTHONE
SpectraBase Compound ID 4cU5o2Tsf8o
InChI InChI=1S/C27H18ClNO4/c28-16-12-10-15(11-13-16)19-14-20-24(30)18-8-4-5-9-21(18)33-25(20)23-22(19)26(31)29(27(23)32)17-6-2-1-3-7-17/h1-14,19,22-23,25H/t19-,22-,23-,25+/m1/s1
InChIKey ULVIAQYOPBBIMV-VRAWNYFSSA-N
Mol Weight 455.9 g/mol
Molecular Formula C27H18ClNO4
Exact Mass 455.092436 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8jrVnNGVsBu
Name (3aR,4S,11aR,11bR)-4-(4-chlorophenyl)-2-phenyl-3a,4,11a,11b-tetrahydrochromeno[2,3-e]isoindole-1,3,6-trione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H18ClNO4
InChI InChI=1S/C27H18ClNO4/c28-16-12-10-15(11-13-16)19-14-20-24(30)18-8-4-5-9-21(18)33-25(20)23-22(19)26(31)29(27(23)32)17-6-2-1-3-7-17/h1-14,19,22-23,25H/t19-,22-,23-,25+/m1/s1
InChIKey ULVIAQYOPBBIMV-VRAWNYFSSA-N
Molecular Weight 455.897 g/mol
SMILES C1(N(C([C@@]2([C@](C=C3[C@@]([C@]12[H])(Oc1c(C3=O)cccc1)[H])(c1ccc(cc1)Cl)[H])[H])=O)c1ccccc1)=O
SPLASH splash10-0kmr-2901500000-966cf6649da7780a86dc
Source of Spectrum H-2005-2984-10
Synonyms (3aR,4S,11aR,11bR)-4-(4-chlorophenyl)-2-phenyl-3a,4,11a,11b-tetrahydrochromen[2,3-e]isoindole-1,3,6-trione (3aR,4S,11aR,11bR)-4-(4-chlorophenyl)-2-phenyl-3a,4,11a,11b-tetrahydro[1]benzopyrano[2,3-e]isoindole-1,3,6-trione
Wiley ID 1563048