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5-hydroxy-5-(4-methoxyphenyl)-3-methyl-2-pyrazoline-1-carboxylic acid methyl ester
SpectraBase Compound ID 87hOHcvvjL9
InChI InChI=1S/C13H16N2O4/c1-9-8-13(17,15(14-9)12(16)19-3)10-4-6-11(18-2)7-5-10/h4-7,17H,8H2,1-3H3
InChIKey BOZOVJLCUNMJGB-UHFFFAOYSA-N
Mol Weight 264.28 g/mol
Molecular Formula C13H16N2O4
Exact Mass 264.111007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4aq8xCL8dgW
Name 5-hydroxy-5-(4-methoxyphenyl)-3-methyl-2-pyrazoline-1-carboxylic acid methyl ester
Alternate Name(s) 5-hydroxy-5-(4-methoxyphenyl)-3-methyl-4H-pyrazole-1-carboxylic acid methyl ester methyl 5-(4-methoxyphenyl)-3-methyl-5-oxidanyl-4H-pyrazole-1-carboxylate methyl 5-hydroxy-5-(4-methoxyphenyl)-3-methyl-4,5-dihydro-1H-pyrazole-1-carboxylate methyl 5-hydroxy-5-(4-methoxyphenyl)-3-methyl-4H-pyrazole-1-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C13H16N2O4
InChI InChI=1S/C13H16N2O4/c1-9-8-13(17,15(14-9)12(16)19-3)10-4-6-11(18-2)7-5-10/h4-7,17H,8H2,1-3H3
InChIKey BOZOVJLCUNMJGB-UHFFFAOYSA-N
Molecular Weight 264.281 g/mol
SMILES OC1(N(N=C(C)C1)C(=O)OC)c1ccc(cc1)OC
SPLASH splash10-000i-0920000000-caf6cc37f99602fddb68
Source of Spectrum H1-51-2681-10
Wiley ID 817509