| SpectraBase Spectrum ID |
F5JRv6SkEsk |
| Name |
3-thioxo-2,3,4,7,8,9-hexahydro-1H-benzo[6',7']cyclohepta[1',2':4,5]pyrido[2,3-d]pyrimidin-1-one |
| Appearance |
Pale yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H13N3OS |
| InChI |
InChI=1S/C16H13N3OS/c20-15-13-12-10(8-17-14(13)18-16(21)19-15)6-3-5-9-4-1-2-7-11(9)12/h1-2,4,7-8H,3,5-6H2,(H2,17,18,19,20,21) |
| InChIKey |
WUORWJMNJBFZHN-UHFFFAOYSA-N |
| Instrument Name |
GCMS Q1000-EX Shimadzu/GCMS 5988-A HP |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0010.a06 |
| Molecular Weight |
295.360 g/mol |
| SMILES |
N1C(c2c(ncc3c2-c2c(CCC3)cccc2)NC1=S)=O |
| SPLASH |
splash10-0002-0090000000-e9cca51e23d8c519f999 |
| Source of Spectrum |
ARK-2009-59-3 |
| Wiley ID |
1866495 |
![3-thioxo-2,3,4,7,8,9-hexahydro-1H-benzo[6',7']cyclohepta[1',2':4,5]pyrido[2,3-d]pyrimidin-1-one](/api/spectrum/F5JRv6SkEsk/structure.png?h=300&w=458 "3-thioxo-2,3,4,7,8,9-hexahydro-1H-benzo[6',7']cyclohepta[1',2':4,5]pyrido[2,3-d]pyrimidin-1-one")
