| SpectraBase Spectrum ID |
4P7Xt9TWomK |
| Name |
5-Allyl-1-methyl-5-(1'-methylpent-2'-ynyl)barbituric Acid |
| Alternate Name(s) |
Methohexital
5-Allyl-5-(hex-3-yn-2-yl)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18N2O3 |
| InChI |
InChI=1S/C14H18N2O3/c1-5-7-8-10(3)14(9-6-2)11(17)15-13(19)16(4)12(14)18/h6,10H,2,5,9H2,1,3-4H3,(H,15,17,19) |
| InChIKey |
NZXKDOXHBHYTKP-UHFFFAOYSA-N |
| Molecular Weight |
262.309 g/mol |
| SMILES |
N1C(C(C(N(C1=O)C)=O)(C(C#CCC)C)CC=C)=O |
| SPLASH |
splash10-001i-5190000000-f784ec5203d4c63f1ae3 |
| Source of Spectrum |
U2-1999-59-59_1 |
| Wiley ID |
1790732 |
