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6-Chloro-1-(4-methoxy-3-nitrobenzyl)-3-methyl-2,4(1H,3H)-pyrimidinedione
SpectraBase Compound ID EWDysVTkiLS
InChI InChI=1S/C13H12ClN3O5/c1-15-12(18)6-11(14)16(13(15)19)7-8-3-4-10(22-2)9(5-8)17(20)21/h3-6H,7H2,1-2H3
InChIKey NZGCINDVMNZPBB-UHFFFAOYSA-N
Mol Weight 325.71 g/mol
Molecular Formula C13H12ClN3O5
Exact Mass 325.046548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3Ro7h5CbXU
Name 6-Chloro-1-(4-methoxy-3-nitrobenzyl)-3-methyl-2,4(1H,3H)-pyrimidinedione
CAS Registry Number 121593-89-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12ClN3O5
InChI InChI=1S/C13H12ClN3O5/c1-15-12(18)6-11(14)16(13(15)19)7-8-3-4-10(22-2)9(5-8)17(20)21/h3-6H,7H2,1-2H3
InChIKey NZGCINDVMNZPBB-UHFFFAOYSA-N
Molecular Weight 325.708 g/mol
SMILES COc1ccc(cc1N(=O)=O)CN1C(N(C)C(C=C1Cl)=O)=O
SPLASH splash10-014l-9400000000-065ccb147d5f5f6abdf6
Source of Spectrum AD-0-2532-0
Synonyms 6-Chloranyl-1-[(4-methoxy-3-nitro-phenyl)methyl]-3-methyl-pyrimidine-2,4-dione 6-Chloro-1-(4-methoxy-3-nitro-benzyl)-3-methyl-pyrimidine-2,4-quinone 6-Chloro-1-[(4-methoxy-3-nitro-phenyl)methyl]-3-methyl-pyrimidine-2,4-dione Pyrimidine-2,4(1H,3H)-dione, 6-chloro-1-(3-methoxy-4-nitrobenzyl)-3-methyl-
Wiley ID 1430336