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(4aR,6aS,12aS)-1,2,3,4,4a,6,6a,12a-octahydroisoindolo[2,3-a]quinazoline-5,11-dione
SpectraBase Compound ID 2Sf82qtHXex
InChI InChI=1S/C15H16N2O2/c18-14-11-7-3-4-8-12(11)17-13(16-14)9-5-1-2-6-10(9)15(17)19/h1-2,5-6,11-13H,3-4,7-8H2,(H,16,18)/t11-,12+,13+/m1/s1
InChIKey MLYCRMHWHUSPOT-AGIUHOORSA-N
Mol Weight 256.3 g/mol
Molecular Formula C15H16N2O2
Exact Mass 256.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7eJUSp64Cjm
Name (4aR,6aS,12aS)-1,2,3,4,4a,6,6a,12a-octahydroisoindolo[2,3-a]quinazoline-5,11-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16N2O2
InChI InChI=1S/C15H16N2O2/c18-14-11-7-3-4-8-12(11)17-13(16-14)9-5-1-2-6-10(9)15(17)19/h1-2,5-6,11-13H,3-4,7-8H2,(H,16,18)/t11-,12+,13+/m1/s1
InChIKey MLYCRMHWHUSPOT-AGIUHOORSA-N
Literature Reference DOI 10.1002/rcm.2880
Molecular Weight 256.305 g/mol
SMILES N1[C@]2(N([C@@]3([C@](C1=O)(CCCC3)[H])[H])C(c1c2cccc1)=O)[H]
SPLASH splash10-0a4i-3690000000-10eb47a6126e59bea529
Source of Spectrum RCM-21-657-7
Synonyms (4aR,6aS,12aS)-1,2,3,4,4a,6,6a,12a-octahydroisoindolo[2,1-a]quinazoline-5,11-dione
Wiley ID 1814416