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Ethyl 4-[N-(benzyloxycarbonyl)-N-(2-methyl-6,7-methylenedioxyquinazolin-4-ylmethyl)amino]benzoate
SpectraBase Compound ID 4dPEHvC4MN4
InChI InChI=1S/C28H25N3O6/c1-3-34-27(32)20-9-11-21(12-10-20)31(28(33)35-16-19-7-5-4-6-8-19)15-24-22-13-25-26(37-17-36-25)14-23(22)29-18(2)30-24/h4-14H,3,15-17H2,1-2H3
InChIKey CXOORPREPBPNBY-UHFFFAOYSA-N
Mol Weight 499.52 g/mol
Molecular Formula C28H25N3O6
Exact Mass 499.174336 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5MzT37b6W7M
Name Ethyl 4-[N-(benzyloxycarbonyl)-N-(2-methyl-6,7-methylenedioxyquinazolin-4-ylmethyl)amino]benzoate
CAS Registry Number 85591-07-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H25N3O6
InChI InChI=1S/C28H25N3O6/c1-3-34-27(32)20-9-11-21(12-10-20)31(28(33)35-16-19-7-5-4-6-8-19)15-24-22-13-25-26(37-17-36-25)14-23(22)29-18(2)30-24/h4-14H,3,15-17H2,1-2H3
InChIKey CXOORPREPBPNBY-UHFFFAOYSA-N
Molecular Weight 499.523 g/mol
SMILES c1(c2c(cc3c(c2)OCO3)nc(n1)C)CN(C(OCc1ccccc1)=O)c1ccc(C(=O)OCC)cc1
SPLASH splash10-0006-9033300000-d7c13f31db6e5a55e220
Source of Spectrum W5-1989-35048-30488
Synonyms Ethyl 4-{[(benzyloxy)carbonyl][(6-methyl[1,3]dioxolo[4,5-g]quinazolin-8-yl)methyl]amino}benzoate
Wiley ID 1398727