| SpectraBase Spectrum ID |
8eeuMrRa2JE |
| Name |
3-thioxo-3,4,7,8-tetrahydrobenzo[f]pyrimido[4,5-c]isoqui nolin-1(2H)-one |
| Appearance |
Yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H11N3OS |
| InChI |
InChI=1S/C15H11N3OS/c19-14-12-11-9(7-16-13(12)17-15(20)18-14)6-5-8-3-1-2-4-10(8)11/h1-4,7H,5-6H2,(H2,16,17,18,19,20) |
| InChIKey |
VAQHKYCUSTXISE-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-Q1000-EX & GCMS 5988-A HP |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2632 |
| Molecular Weight |
281.333 g/mol |
| SMILES |
N1c2ncc3CCc4ccccc4-c3c2C(NC1=S)=O |
| SPLASH |
splash10-001i-1390000000-bd1189b9fd717b11524c |
| Source of Spectrum |
Y-54-613-4 |
| Wiley ID |
1877921 |
![3-thioxo-3,4,7,8-tetrahydrobenzo[f]pyrimido[4,5-c]isoqui nolin-1(2H)-one](/api/spectrum/8eeuMrRa2JE/structure.png?h=300&w=458 "3-thioxo-3,4,7,8-tetrahydrobenzo[f]pyrimido[4,5-c]isoqui nolin-1(2H)-one")
