SpectraBase Spectrum ID |
4O8JoY0453B |
Name |
(3-(4'-Methylphenyl)-2-oxo-2H-[1,2,4]triazino[2,3-c]quinazolin-6-yl)butanoicacid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H18N4O3 |
InChI |
InChI=1S/C21H18N4O3/c1-13-9-11-14(12-10-13)19-21(28)23-20-15-5-2-3-6-16(15)22-17(25(20)24-19)7-4-8-18(26)27/h2-3,5-6,9-12H,4,7-8H2,1H3,(H,26,27) |
InChIKey |
KDVGVOMDKHEDLC-UHFFFAOYSA-N |
Instrument Name |
Varian 1200 L |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/jhet.2120 |
Molecular Weight |
374.400 g/mol |
SMILES |
OC(CCCC=1N2C(=NC(C(c3ccc(cc3)C)=N2)=O)c2c(N1)cccc2)=O |
SPLASH |
splash10-000j-1900000000-21472a72513d2b212c4c |
Source of Spectrum |
Y-53-781-4.11 |
Wiley ID |
1876391 |