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2,4-Bis(methylsulfonyl)-7-phenyl-8a,9-dihydro-5H-pyrrolo[3,4-g]quinazoline-6,8(5aH,7H)-dione
SpectraBase Compound ID FwTBOeRAB2L
InChI InChI=1S/C18H17N3O6S2/c1-28(24,25)15-13-8-11-12(9-14(13)19-18(20-15)29(2,26)27)17(23)21(16(11)22)10-6-4-3-5-7-10/h3-7,11-12H,8-9H2,1-2H3
InChIKey BKRKTQGVEXZQDC-UHFFFAOYSA-N
Mol Weight 435.47 g/mol
Molecular Formula C18H17N3O6S2
Exact Mass 435.055878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8qvFCS4InjK
Name 2,4-Bis(methylsulfonyl)-7-phenyl-8a,9-dihydro-5H-pyrrolo[3,4-g]quinazoline-6,8(5aH,7H)-dione
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17N3O6S2
InChI InChI=1S/C18H17N3O6S2/c1-28(24,25)15-13-8-11-12(9-14(13)19-18(20-15)29(2,26)27)17(23)21(16(11)22)10-6-4-3-5-7-10/h3-7,11-12H,8-9H2,1-2H3
InChIKey BKRKTQGVEXZQDC-UHFFFAOYSA-N
Molecular Weight 435.469 g/mol
SMILES C1(N(C(C2Cc3nc(nc(c3CC12)S(=O)(=O)C)S(=O)(=O)C)=O)c1ccccc1)=O
SPLASH splash10-03dr-0205900000-84bded8011ff2c06903b
Source of Spectrum F-65-1702-15
Wiley ID 1681787