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Ethyl 4-(formyl[(6-methyl[1,3]dioxolo[4,5-g]quinazolin-8-yl)methyl]amino)benzoate
SpectraBase Compound ID 3J4YLNDwVZO
InChI InChI=1S/C21H19N3O5/c1-3-27-21(26)14-4-6-15(7-5-14)24(11-25)10-18-16-8-19-20(29-12-28-19)9-17(16)22-13(2)23-18/h4-9,11H,3,10,12H2,1-2H3
InChIKey NPAWJOQRXHLEJY-UHFFFAOYSA-N
Mol Weight 393.4 g/mol
Molecular Formula C21H19N3O5
Exact Mass 393.132471 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HJ1SRJtVVIu
Name Ethyl 4-(formyl[(6-methyl[1,3]dioxolo[4,5-g]quinazolin-8-yl)methyl]amino)benzoate
Alternate Name(s) 4-[formyl-[(6-methyl-[1,3]dioxolo[4,5-g]quinazolin-8-yl)methyl]amino]benzoic acid ethyl ester Ethyl 4-[methanoyl-[(6-methyl-[1,3]dioxolo[4,5-g]quinazolin-8-yl)methyl]amino]benzoate Ethyl 4-[N-formyl-N-(2-methyl-6,7-methylenedioxyquinazolin-4-ylmethyl)amino]benzoate
CAS Registry Number 85591-05-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19N3O5
InChI InChI=1S/C21H19N3O5/c1-3-27-21(26)14-4-6-15(7-5-14)24(11-25)10-18-16-8-19-20(29-12-28-19)9-17(16)22-13(2)23-18/h4-9,11H,3,10,12H2,1-2H3
InChIKey NPAWJOQRXHLEJY-UHFFFAOYSA-N
Molecular Weight 393.399 g/mol
SMILES CCOC(c1ccc(cc1)N(Cc1c2cc3c(cc2nc(C)n1)OCO3)C=O)=O
SPLASH splash10-0uy0-0669000000-de9d2488709894de8a18
Source of Spectrum W5-1989-35050-30486
Wiley ID 1366256