| SpectraBase Spectrum ID |
326SPv7vxdJ |
| Name |
10(E)-.beta.-Santalic acid |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H22O2 |
| InChI |
InChI=1S/C15H22O2/c1-10(14(16)17)5-4-8-15(3)11(2)12-6-7-13(15)9-12/h5,12-13H,2,4,6-9H2,1,3H3,(H,16,17)/b10-5+/t12-,13+,15+/m1/s1 |
| InChIKey |
PMCPDNGTLRPFQQ-MEPYFGFUSA-N |
| Instrument Name |
Micromass AutoSpec OA-TOF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np050386x |
| Molecular Weight |
234.339 g/mol |
| Optical Rotation |
[a]D20 = -77.2 (c = 1.0, CHCl3) |
| Reported Formula |
C15H22O2 |
| SMILES |
OC(\C(=C\CC[C@]1(C([C@]2(C[C@@]1(CC2)[H])[H])=C)C)C)=O |
| SPLASH |
splash10-0a4i-9600000000-cd688a9c715848eb17a3 |
| Source of Spectrum |
G4-68-1808-6 |
| Wiley ID |
1879513 |
