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1,3-Dimethyl-5-nitrouracil hydrate
SpectraBase Compound ID 1k6rmjVj0LQ
InChI InChI=1S/C6H7N3O4.O/c1-7-3-4(9(12)13)5(10)8(2)6(7)11;/h3H,1-2H3;
InChIKey RNYVIICMUMGOGK-UHFFFAOYSA-N
Mol Weight 201.14 g/mol
Molecular Formula C6H7N3O5
Exact Mass 201.03857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8UFbQe714TM
Name 2,4(1H,3H)-Pyrimidinedione, 1,3-dimethyl-5-nitro-, monohydrate
CAS Registry Number 69796-45-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9N3O5
InChI InChI=1S/C6H7N3O4.O/c1-7-3-4(9(12)13)5(10)8(2)6(7)11;/h3H,1-2H3;
InChIKey RNYVIICMUMGOGK-UHFFFAOYSA-N
Molecular Weight 203.154 g/mol
SMILES O.C=1(C(N(C)C(N(C1)C)=O)=O)N(=O)=O
SPLASH splash10-00lf-9300000000-cc67a08c27b2e3b6a0fc
Source of Spectrum W5-15882-0-0
Synonyms 1,3-Dimethyl-5-nitro-2,4(1H,3H)-pyrimidinedione hydrate 1,3-Dimethyl-5-nitro-pyrimidine-2,4-dione hydrate 1,3-Dimethyl-5-nitro-pyrimidine-2,4-quinone hydrate 1,3-Dimethyl-5-nitropyrimidine-2,4-dione;hydrate 1,3-Dimethyl-5-nitro-pyrimidine-2,4-dione;hydrate
Wiley ID 1200510