| SpectraBase Spectrum ID |
93wjQwKCgBb |
| Name |
2-O-methylclivonine |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H21NO5 |
| InChI |
InChI=1S/C18H21NO5/c1-19-4-3-9-5-14(21-2)17-15(16(9)19)10-6-12-13(23-8-22-12)7-11(10)18(20)24-17/h6-7,9,14-17H,3-5,8H2,1-2H3/t9-,14+,15+,16-,17+/m1/s1 |
| InChIKey |
OLKFANWXSFZICZ-VKUSEKQFSA-N |
| Instrument Name |
Agilent 6890 + MSD 5975 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np3003595 |
| Molecular Weight |
331.368 g/mol |
| Optical Rotation |
[a]22D = +14 (c = 0.13, CHCl3) |
| Reported Formula |
C18H22NO5 |
| SMILES |
c1c2c(cc3c1OCO3)[C@@]1([C@@](OC2=O)([C@](C[C@@]2([C@]1(N(CC2)C)[H])[H])(OC)[H])[H])[H] |
| SPLASH |
splash10-001i-9001000000-77b8ff28a8c9b51072f2 |
| Source of Spectrum |
G4-75-1644-11 |
| Wiley ID |
1854829 |
