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1,3-Dimethyl-6,7-dinitro-1H,2H,3H,4H,5H-pyrrolo[3,2-d]pyrimidine-2,4-dione

View entire compound with spectra: 1 MS (GC)

1,3-Dimethyl-6,7-dinitro-1H,2H,3H,4H,5H-pyrrolo[3,2-d]pyrimidine-2,4-dione
SpectraBase Compound ID 46Yj8EWXIYt
InChI InChI=1S/C8H7N5O6/c1-10-4-3(7(14)11(2)8(10)15)9-6(13(18)19)5(4)12(16)17/h9H,1-2H3
InChIKey SWKMIZVYJHRLFU-UHFFFAOYSA-N
Mol Weight 269.17 g/mol
Molecular Formula C8H7N5O6
Exact Mass 269.039633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H1P6mYMGdgI
Name 1,3-Dimethyl-6,7-dinitro-1H,2H,3H,4H,5H-pyrrolo[3,2-d]pyrimidine-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7N5O6
InChI InChI=1S/C8H7N5O6/c1-10-4-3(7(14)11(2)8(10)15)9-6(13(18)19)5(4)12(16)17/h9H,1-2H3
InChIKey SWKMIZVYJHRLFU-UHFFFAOYSA-N
Molecular Weight 269.173 g/mol
SMILES [nH]1c(c(c2N(C(N(C(c12)=O)C)=O)C)N(=O)=O)N(=O)=O
SPLASH splash10-015c-9560000000-e8da60061148ac78ab20
Source of Spectrum IY-2-5201-9
Synonyms 1H-Pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione, 1,3-dimethyl-6,7-dinitro- 1,3-Dimethyl-6,7-dinitro-5H-pyrrolo[3,2-d]pyrimidine-2,4-dione
Wiley ID 1660002