SpectraBase Spectrum ID |
4cqiLVRrpkr |
Name |
(+/-)-(1R,4bS,8aR,10aR)-4b,8,8,10a-Tetramethyl-7-oxo-1,2,3,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-yl 1H-imidazole-1-thiocarboxylate |
Appearance |
Crystalline solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H30N2O2S |
InChI |
InChI=1S/C22H30N2O2S/c1-20(2)15-8-10-22(4)16(21(15,3)11-9-17(20)25)6-5-7-18(22)26-19(27)24-13-12-23-14-24/h6,12-15,18H,5,7-11H2,1-4H3/t15-,18+,21-,22+/m0/s1 |
InChIKey |
HOXOPGBXBPJUDX-HOWVWPRWSA-N |
Instrument Name |
Micromass 70-VSE |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/jm101445p |
Molecular Weight |
386.554 g/mol |
Reported Formula |
C22H30N2O2S |
SMILES |
C1C(C([C@]2([C@](C1)(C=1[C@@](CC2)([C@@](CCC1)(OC([n]1cncc1)=S)[H])C)C)[H])(C)C)=O |
SPLASH |
splash10-0a4i-0290000000-21bc0005a4c8601d8109 |
Source of Spectrum |
AF-54-SM49-52 |
Wiley ID |
1848781 |