| SpectraBase Spectrum ID |
2F0AWZFN2LJ |
| Name |
(1S,4aR,5S)-5-(2-cyano-6-methylbenzyl)-1,4a-dimethyl-6-methylene-decahydronaphthalene-1-carboxylic acid methyl ester |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H31NO2 |
| InChI |
InChI=1S/C24H31NO2/c1-16-8-6-9-18(15-25)19(16)14-20-17(2)10-11-21-23(20,3)12-7-13-24(21,4)22(26)27-5/h6,8-9,20-21H,2,7,10-14H2,1,3-5H3/t20-,21?,23+,24-/m0/s1 |
| InChIKey |
JCRDMTPKARSKSC-RINHOTFJSA-N |
| Ionization Type |
EI |
| Molecular Weight |
365.517 g/mol |
| Optical Rotation |
[a]D = -21.2 (c = 0.9, CHCl3) |
| SMILES |
C1C[C@@](C(=O)OC)(C)C2CCC(=C)[C@](Cc3c(C)cccc3C#N)([C@@]2(C)C1)[H] |
| SPLASH |
splash10-0560-9800000000-b8060928e25d8d4681f3 |
| Source of Spectrum |
ES2327196B2 |
| Wiley ID |
1841920 |
