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1-(4-Fluorophenyl)-5-methoxycarbonylmethyl-6-oxo-1,4,5,6-tetrahydro-[1,2,4]triazine-3-carboxylic acid, methyl ester
SpectraBase Compound ID H4oak3peLLf
InChI InChI=1S/C14H14FN3O5/c1-22-11(19)7-10-13(20)18(9-5-3-8(15)4-6-9)17-12(16-10)14(21)23-2/h3-6,10H,7H2,1-2H3,(H,16,17)
InChIKey ZMPLUEFSYNJJDD-UHFFFAOYSA-N
Mol Weight 323.28 g/mol
Molecular Formula C14H14FN3O5
Exact Mass 323.091749 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3WD1DqcNqOe
Name 1-(4-FLUOROPHENYL)-5-METHOXYCARBONYLMETHYL-6-OXO-1,4,5,6-TETRAHYDRO-[1,2,4]TRIAZINE-3-CARBOXYLIC ACID, METHYL ESTER
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Formula C14H14FN3O5
InChI InChI=1S/C14H14FN3O5/c1-22-11(19)7-10-13(20)18(9-5-3-8(15)4-6-9)17-12(16-10)14(21)23-2/h3-6,10H,7H2,1-2H3,(H,16,17)
InChIKey ZMPLUEFSYNJJDD-UHFFFAOYSA-N
Molecular Weight 323.0914
SMILES N1C(C(N(N=C1C(OC)=O)c1ccc(F)cc1)=O)CC(OC)=O
SPLASH splash10-00dl-5953000000-706f403d7258462a58a9
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany