| SpectraBase Spectrum ID |
JCFOqsg9UnU |
| Name |
(1S,2S,3R,6S)-4-(Acetoxymethyl)-6-(4-butyl-1H-1,2,3-triazol-1-yl)cyclohex-4-ene-1,2,3-triyl Triacetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H29N3O8 |
| InChI |
InChI=1S/C21H29N3O8/c1-6-7-8-17-10-24(23-22-17)18-9-16(11-29-12(2)25)19(30-13(3)26)21(32-15(5)28)20(18)31-14(4)27/h9-10,18-21H,6-8,11H2,1-5H3/t18-,19+,20-,21-/m0/s1 |
| InChIKey |
MQSLQMAISAIZPG-WOZUAGRISA-N |
| Molecular Weight |
451.476 g/mol |
| SMILES |
[C@]1([n]2nnc(c2)CCCC)([C@@]([C@@](OC(=O)C)([C@@](C(=C1)COC(=O)C)(OC(=O)C)[H])[H])(OC(=O)C)[H])[H] |
| SPLASH |
splash10-01bc-4900000000-309cb4ccf18f4d6a4e1e |
| Source of Spectrum |
U1-2014-3632-14g |
| Wiley ID |
1740705 |
