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Phthalic acid, neopentyl 4-nitrophenyl ester
SpectraBase Compound ID 6HvT945q7lm
InChI InChI=1S/C19H19NO6/c1-19(2,3)12-25-17(21)15-6-4-5-7-16(15)18(22)26-14-10-8-13(9-11-14)20(23)24/h4-11H,12H2,1-3H3
InChIKey KEAVYXDHIRXLPT-UHFFFAOYSA-N
Mol Weight 357.36 g/mol
Molecular Formula C19H19NO6
Exact Mass 357.121237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3uP55LPCt2B
Name Phthalic acid, neopentyl 4-nitrophenyl ester
Alternate Name(s) benzene-1,2-dicarboxylic acid O1-(2,2-dimethylpropyl) ester O2-(4-nitrophenyl) ester 1-O-(2,2-dimethylpropyl) 2-O-(4-nitrophenyl) benzene-1,2-dicarboxylate O1-(2,2-dimethylpropyl) O2-(4-nitrophenyl) benzene-1,2-dicarboxylate
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Formula C19H19NO6
InChI InChI=1S/C19H19NO6/c1-19(2,3)12-25-17(21)15-6-4-5-7-16(15)18(22)26-14-10-8-13(9-11-14)20(23)24/h4-11H,12H2,1-3H3
InChIKey KEAVYXDHIRXLPT-UHFFFAOYSA-N
Molecular Weight 357.362 g/mol
SMILES c1c(c(ccc1)C(Oc1ccc(cc1)N(=O)=O)=O)C(OCC(C)(C)C)=O
SPLASH splash10-00dj-9830000000-c0483b101e0cf75de341
Source of Spectrum NP-13-90-0
Wiley ID 1110736