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(3aR,9aR,9bS)-5,8-Dimethyl-2-phenyl-3a,4,6,9,9a,9b-hexahydro-1H-benzo[e]isoindole-1,3(2H)-dione
SpectraBase Compound ID 9HQNhBuRGYo
InChI InChI=1S/C20H21NO2/c1-12-8-9-15-13(2)11-17-18(16(15)10-12)20(23)21(19(17)22)14-6-4-3-5-7-14/h3-8,16-18H,9-11H2,1-2H3/t16-,17+,18-/m0/s1
InChIKey JSZOHYVWWGIZDQ-KSZLIROESA-N
Mol Weight 307.39 g/mol
Molecular Formula C20H21NO2
Exact Mass 307.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FW7BiOtzZpt
Name (3aR,9aR,9bS)-5,8-Dimethyl-2-phenyl-3a,4,6,9,9a,9b-hexahydro-1H-benzo[e]isoindole-1,3(2H)-dione
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Formula C20H21NO2
InChI InChI=1S/C20H21NO2/c1-12-8-9-15-13(2)11-17-18(16(15)10-12)20(23)21(19(17)22)14-6-4-3-5-7-14/h3-8,16-18H,9-11H2,1-2H3/t16-,17+,18-/m0/s1
InChIKey JSZOHYVWWGIZDQ-KSZLIROESA-N
Literature Reference DOI 10.1560/8E4X-0U34-MQYD-0H20
Molecular Weight 307.393 g/mol
SMILES C1(N(C([C@]2([C@@]3(C(=C(C[C@@]12[H])C)CC=C(C3)C)[H])[H])=O)c1ccccc1)=O
SPLASH splash10-056r-0906000000-2e71344725a8ad3ef6d3
Source of Spectrum TI-41-323-5
Wiley ID 1806654