| SpectraBase Spectrum ID |
DCrnBxv6duT |
| Name |
(2S*,4S*)-4-Acetoxy-3-methylene-2-(4'-phenyl-1',2',4'-triazolidine-3',5'-dion-1'-yl)octane |
| Alternate Name(s) |
(1S)-1-butyl-2-[(1S)-1-(3,5-dioxo-4-phenyl-1,2,4-triazolidin-1-yl)ethyl]-2-propenyl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H25N3O4 |
| InChI |
InChI=1S/C19H25N3O4/c1-5-6-12-17(26-15(4)23)13(2)14(3)22-19(25)21(18(24)20-22)16-10-8-7-9-11-16/h7-11,14,17H,2,5-6,12H2,1,3-4H3,(H,20,24)/t14-,17-/m0/s1 |
| InChIKey |
QYLAADYPZIBAJT-YOEHRIQHSA-N |
| Molecular Weight |
359.426 g/mol |
| SMILES |
N1C(N(C(N1[C@](C([C@@](OC(=O)C)(CCCC)[H])=C)(C)[H])=O)c1ccccc1)=O |
| SPLASH |
splash10-0002-0290000000-810f28b394eaedee267c |
| Source of Spectrum |
J-64-2200-8 |
| Wiley ID |
1529702 |
