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Cyclopent[f]isoindole-1,3(2H,3aH)-dione, 6,6-diacetyl-4,5,6,7,8,8a-hexahydro-2-phenyl-, cis-
SpectraBase Compound ID 9BR5Ab9Y5NP
InChI InChI=1S/C21H21NO4/c1-12(23)21(13(2)24)10-14-8-17-18(9-15(14)11-21)20(26)22(19(17)25)16-6-4-3-5-7-16/h3-7,17-18H,8-11H2,1-2H3/t17-,18+
InChIKey TWLBDZFEZUYJEP-HDICACEKSA-N
Mol Weight 351.4 g/mol
Molecular Formula C21H21NO4
Exact Mass 351.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7NKzydVNMFg
Name Cyclopent[f]isoindole-1,3(2H,3aH)-dione, 6,6-diacetyl-4,5,6,7,8,8a-hexahydro-2-phenyl-, cis-
CAS Registry Number 118453-26-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO4
InChI InChI=1S/C21H21NO4/c1-12(23)21(13(2)24)10-14-8-17-18(9-15(14)11-21)20(26)22(19(17)25)16-6-4-3-5-7-16/h3-7,17-18H,8-11H2,1-2H3/t17-,18+
InChIKey TWLBDZFEZUYJEP-HDICACEKSA-N
Molecular Weight 351.402 g/mol
SMILES C1(N(C([C@]2(CC=3CC(CC3C[C@@]12[H])(C(=O)C)C(=O)C)[H])=O)c1ccccc1)=O
SPLASH splash10-0a4l-5119000000-98189dfe4ec81740942a
Source of Spectrum F-44-2047-33
Synonyms (3aR,8aS)-6,6-diacetyl-2-phenyl-4,5,6,7,8,8a-hexahydrocyclopenta[f]isoindole-1,3(2H,3aH)-dione 6,6-Di(methylcarbonyl)-1,3-dioxy-2(n)-phenyl(bicyclo[4.3.0]non-3a-eno)[5,6-c]tetrahydropyrrole
Wiley ID 1342669