| SpectraBase Spectrum ID |
2QJzTCP4a |
| Name |
Benzyl (S,E)-2,3-dihydrofarnesoate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H32O2 |
| InChI |
InChI=1S/C22H32O2/c1-18(2)10-8-11-19(3)12-9-13-20(4)16-22(23)24-17-21-14-6-5-7-15-21/h5-7,10,12,14-15,20H,8-9,11,13,16-17H2,1-4H3/b19-12+/t20-/m0/s1 |
| InChIKey |
KDXJTFHWKSODHC-RQRMZWKBSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/cbic.202100372 |
| Molecular Weight |
328.496 g/mol |
| Optical Rotation |
[a]D25.0 = -0.82 (c = 1.22, CH2Cl2) |
| Reported Formula |
C22H32O2 |
| SMILES |
C(C[C@@](CC(=O)OCc1ccccc1)(C)[H])\C=C\(CCC=C(C)C)C |
| SPLASH |
splash10-00kf-9000000000-658128488b7c729f620c |
| Source of Spectrum |
CBC-22-SM53-(S)-8o |
| Wiley ID |
1865295 |
