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Pyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione, 4-cyclopropyltetrahydro-4-methyl-2-phenyl-6-(2-pyridinyl)-, (3a.alpha.,4.alpha.,6.beta.,6a.alp ha.)-
SpectraBase Compound ID FWLvAEt6EBc
InChI InChI=1S/C21H21N3O2/c1-21(13-10-11-13)17-16(18(23-21)15-9-5-6-12-22-15)19(25)24(20(17)26)14-7-3-2-4-8-14/h2-9,12-13,16-18,23H,10-11H2,1H3/t16-,17-,18-,21+/m0/s1
InChIKey WZQAWCNQNWVJJD-RYLXDESZSA-N
Mol Weight 347.42 g/mol
Molecular Formula C21H21N3O2
Exact Mass 347.163377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID lvHQEpfVQt
Name Pyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione, 4-cyclopropyltetrahydro-4-methyl-2-phenyl-6-(2-pyridinyl)-, (3a.alpha.,4.alpha.,6.beta.,6a.alp ha.)-
Alternate Name(s) (3aR,4R,6R,6aS)-4-cyclopropyl-4-methyl-2-phenyl-6-(2-pyridinyl)tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione 2-Cyclopropyl-2-methyl-4-(2-pyridyl)-7-phenyl-6,8-dioxo-3,7-diazabicyclo[3.3.0]octane
CAS Registry Number 118328-32-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21N3O2
InChI InChI=1S/C21H21N3O2/c1-21(13-10-11-13)17-16(18(23-21)15-9-5-6-12-22-15)19(25)24(20(17)26)14-7-3-2-4-8-14/h2-9,12-13,16-18,23H,10-11H2,1H3/t16-,17-,18-,21+/m0/s1
InChIKey WZQAWCNQNWVJJD-RYLXDESZSA-N
Molecular Weight 347.418 g/mol
SMILES N1[C@]([C@@]2([C@]([C@]1(C1CC1)C)(C(N(C2=O)c1ccccc1)=O)[H])[H])(c1ncccc1)[H]
SPLASH splash10-05ai-1906000000-bfd25b44741a52ab568b
Source of Spectrum F-44-1532-26
Wiley ID 1340096