| SpectraBase Spectrum ID |
8ufFMJ9Gdbp |
| Name |
2-n-octadecylthioorotic acid hydrobromide |
| Alternate Name(s) |
1-Octadecyl-6-oxo-2-sulfanylidene-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid hydrobromide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H41BrN2O3S |
| InChI |
InChI=1S/C23H40N2O3S.BrH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-29-23-24-20(22(27)28)19-21(26)25-23;/h19H,2-18H2,1H3,(H,27,28)(H,24,25,26);1H |
| InChIKey |
VQCRTKOUVANQSR-UHFFFAOYSA-N |
| Molecular Weight |
505.556 g/mol |
| SMILES |
[Br-].[NH+]1=C(NC(C=C1C(=O)O)=O)SCCCCCCCCCCCCCCCCCC |
| SPLASH |
splash10-002b-0009000000-f690fee0058d2a97c9f0 |
| Source of Spectrum |
O-29-50-0 |
| Wiley ID |
1399468 |
