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3-(4-nitrophenyl)-1-pyrrolo[2,1-a]phthalazinecarboxylic acid methyl ester
SpectraBase Compound ID CuPIPlAOqvO
InChI InChI=1S/C19H13N3O4/c1-26-19(23)16-10-17(12-6-8-14(9-7-12)22(24)25)21-18(16)15-5-3-2-4-13(15)11-20-21/h2-11H,1H3
InChIKey SSFANYNLGNVWIE-UHFFFAOYSA-N
Mol Weight 347.33 g/mol
Molecular Formula C19H13N3O4
Exact Mass 347.090606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 68kgU6cRdrp
Name 3-(4-nitrophenyl)-1-pyrrolo[2,1-a]phthalazinecarboxylic acid methyl ester
Alternate Name(s) 3-(4-nitrophenyl)pyrrolo[2,1-a]phthalazine-1-carboxylic acid methyl ester methyl 3-(4-nitrophenyl)pyrrolo[2,1-a]phthalazine-1-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C19H13N3O4
InChI InChI=1S/C19H13N3O4/c1-26-19(23)16-10-17(12-6-8-14(9-7-12)22(24)25)21-18(16)15-5-3-2-4-13(15)11-20-21/h2-11H,1H3
InChIKey SSFANYNLGNVWIE-UHFFFAOYSA-N
Molecular Weight 347.330 g/mol
SMILES c1-2[n](N=Cc3ccccc23)c(cc1C(=O)OC)-c1ccc(cc1)N(=O)=O
SPLASH splash10-001i-0900000000-9c693f51f496e419a45d
Source of Spectrum Y-37-1168-9
Wiley ID 762776