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Ethyl 2-[3-(2-carbamoyl-4-oxoquinazolin-3(4H)-yl)prop-1-yn-1-yl]benzoate

View entire compound with spectra: 1 MS (GC)

Ethyl 2-[3-(2-carbamoyl-4-oxoquinazolin-3(4H)-yl)prop-1-yn-1-yl]benzoate
SpectraBase Compound ID JXqIx53mjnq
InChI InChI=1S/C21H17N3O4/c1-2-28-21(27)15-10-4-3-8-14(15)9-7-13-24-19(18(22)25)23-17-12-6-5-11-16(17)20(24)26/h3-6,8,10-12H,2,13H2,1H3,(H2,22,25)
InChIKey ZRJLXEMTRUDHLP-UHFFFAOYSA-N
Mol Weight 375.38 g/mol
Molecular Formula C21H17N3O4
Exact Mass 375.121906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7c469RZiNmO
Name Ethyl 2-[3-(2-carbamoyl-4-oxoquinazolin-3(4H)-yl)prop-1-yn-1-yl]benzoate
Alternate Name(s) Ethyl 2-(3-(2-carbamoyl-4-oxoquinazolin-3(4H)-yl)prop-1-yn-1-yl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17N3O4
InChI InChI=1S/C21H17N3O4/c1-2-28-21(27)15-10-4-3-8-14(15)9-7-13-24-19(18(22)25)23-17-12-6-5-11-16(17)20(24)26/h3-6,8,10-12H,2,13H2,1H3,(H2,22,25)
InChIKey ZRJLXEMTRUDHLP-UHFFFAOYSA-N
Molecular Weight 375.384 g/mol
SMILES NC(C=1N(C(c2c(cccc2)N1)=O)CC#Cc1c(C(=O)OCC)cccc1)=O
SPLASH splash10-004i-1902000000-54e0caad3e740421374f
Source of Spectrum F-69-7069-3c
Wiley ID 1738485