| SpectraBase Spectrum ID |
2ePR1un0rgL |
| Name |
(-)-3-O-acetylspectaline |
| Alternate Name(s) |
(2R,3R,6S)-2-methyl-6-(13-oxotetradecyl)piperidin-3-yl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H41NO3 |
| InChI |
InChI=1S/C22H41NO3/c1-18(24)14-12-10-8-6-4-5-7-9-11-13-15-21-16-17-22(19(2)23-21)26-20(3)25/h19,21-23H,4-17H2,1-3H3/t19-,21+,22-/m1/s1 |
| InChIKey |
LRKWDKCSHJWJST-BAGYTPMASA-N |
| Literature Reference DOI |
10.1002/rcm.8172 |
| Molecular Weight |
367.574 g/mol |
| SMILES |
N1[C@@]([C@@](CC[C@@]1(CCCCCCCCCCCCC(=O)C)[H])(OC(=O)C)[H])(C)[H] |
| SPLASH |
splash10-0a4m-9510000000-5ce507b7e84167b96c2f |
| Source of Spectrum |
RCM-32-SM27-4 |
| Wiley ID |
1813842 |
