SpectraBase Spectrum ID |
CaNaSwxmsTQ |
Name |
5-bromo-4-(tetradecylthio)pyrimidin-2(1H)-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H31BrN2OS |
InChI |
InChI=1S/C18H31BrN2OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-23-17-16(19)15-20-18(22)21-17/h15H,2-14H2,1H3,(H,20,21,22) |
InChIKey |
XMMZJLYUHYAOFI-UHFFFAOYSA-N |
Instrument Name |
AMD 402 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/rcm.1898 |
Molecular Weight |
403.423 g/mol |
Reported Formula |
C18H31N2OSBr |
SMILES |
N1C(N=C(C(=C1)Br)SCCCCCCCCCCCCCC)=O |
SPLASH |
splash10-05fr-0092000000-6fc3f7dfd1848d980588 |
Source of Spectrum |
RCM-19-1210-11 |
Wiley ID |
1836447 |