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1H-Pyrimido[4,5-b]indole-2,4(3H,9H)-dione, 1,3-dimethyl-
SpectraBase Compound ID 8CZRB2qi5Sx
InChI InChI=1S/C12H11N3O2/c1-14-10-9(11(16)15(2)12(14)17)7-5-3-4-6-8(7)13-10/h3-6,13H,1-2H3
InChIKey SXCUVUTYAYNWSD-UHFFFAOYSA-N
Mol Weight 229.24 g/mol
Molecular Formula C12H11N3O2
Exact Mass 229.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GouyrWi9rbL
Name 1H-Pyrimido[4,5-b]indole-2,4(3H,9H)-dione, 1,3-dimethyl-
CAS Registry Number 55832-88-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N3O2
InChI InChI=1S/C12H11N3O2/c1-14-10-9(11(16)15(2)12(14)17)7-5-3-4-6-8(7)13-10/h3-6,13H,1-2H3
InChIKey SXCUVUTYAYNWSD-UHFFFAOYSA-N
Molecular Weight 229.239 g/mol
SMILES [nH]1c2ccccc2c2c1N(C(N(C2=O)C)=O)C
SPLASH splash10-00gl-0930000000-564fa8a933e7620978c5
Source of Spectrum AH-119-100-4
Synonyms 1,3-Dimethyl-1H-pyrimido[4,5-b]indole-2,4(3H,9H)-dione 1,3-Dimethyl-9H-pyrimido[4,5-b]indole-2,4-dione 1,3-Dimethyl-9H-pyrimid[4,5-b]indole-2,4-quinone
Wiley ID 1230676