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Isopropyl 5,7-dioxo-2-phenyl-3,5,6,7-tetrahydroimidazo[1,5-b]pyridazine-4-carboxylate
SpectraBase Compound ID 8v0JYMTxBAW
InChI InChI=1S/C16H15N3O4/c1-9(2)23-15(21)11-8-12(10-6-4-3-5-7-10)18-19-13(11)14(20)17-16(19)22/h3-7,9H,8H2,1-2H3,(H,17,20,22)
InChIKey SPWYDAYGXRFHMY-UHFFFAOYSA-N
Mol Weight 313.31 g/mol
Molecular Formula C16H15N3O4
Exact Mass 313.106256 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EUXpKZWrA3p
Name Isopropyl 5,7-dioxo-2-phenyl-3,5,6,7-tetrahydroimidazo[1,5-b]pyridazine-4-carboxylate
CAS Registry Number 76089-67-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15N3O4
InChI InChI=1S/C16H15N3O4/c1-9(2)23-15(21)11-8-12(10-6-4-3-5-7-10)18-19-13(11)14(20)17-16(19)22/h3-7,9H,8H2,1-2H3,(H,17,20,22)
InChIKey SPWYDAYGXRFHMY-UHFFFAOYSA-N
Molecular Weight 313.313 g/mol
SMILES N1C(N2N=C(CC(=C2C1=O)C(=O)OC(C)C)c1ccccc1)=O
SPLASH splash10-056r-4981000000-62864516224692b2dbc6
Source of Spectrum W5-1989-33778-31758
Synonyms 2-Phenyl-4-(isopropyloxycarbonyl)-3H-imidazo[1,5-b]pyridazine-5,7-(6H)-dione 5,7-Diketo-2-phenyl-3H-imidazo[1,5-b]pyridazine-4-carboxylic acid isopropyl ester 5,7-Dioxo-2-phenyl-3H-imidazo[1,5-b]pyridazine-4-carboxylic acid propan-2-yl ester isopropyl 5,7-dioxo-2-phenyl-3H-imidazo[1,5-b]pyridazine-4-carboxylate Propan-2-yl 5,7-bis(oxidanylidene)-2-phenyl-3H-imidazo[1,5-b]pyridazine-4-carboxylate Propan-2-yl 5,7-dioxo-2-phenyl-3H-imidazo[1,5-b]pyridazine-4-carboxylate
Wiley ID 1314172