| SpectraBase Spectrum ID |
BSL9cZwvBGY |
| Name |
(2S*,4R*)-3-Methylene-2-(4'-phenyl-1',2',4'-triazolidine-3',5'-dion-1'-yl)octan-4-ol |
| Alternate Name(s) |
1-{(1S)-2-[(1R)-1-hydroxypentyl]-1-methyl-2-propenyl}-4-phenyl-1,2,4-triazolidine-3,5-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H23N3O3 |
| InChI |
InChI=1S/C17H23N3O3/c1-4-5-11-15(21)12(2)13(3)20-17(23)19(16(22)18-20)14-9-7-6-8-10-14/h6-10,13,15,21H,2,4-5,11H2,1,3H3,(H,18,22)/t13-,15+/m0/s1 |
| InChIKey |
XMQJIQVODHMPJD-DZGCQCFKSA-N |
| Molecular Weight |
317.389 g/mol |
| SMILES |
N1C(N(C(N1[C@](C([C@](O)(CCCC)[H])=C)(C)[H])=O)c1ccccc1)=O |
| SPLASH |
splash10-00fs-0931000000-b643c3428f3fa4bfbffc |
| Source of Spectrum |
J-64-2200-7 |
| Wiley ID |
1529709 |
