| SpectraBase Spectrum ID |
4XqLXS2i3RQ |
| Name |
(12S)-12-Acetoxy-15,16-epoxylabda-7,13(16),14-triene |
| Appearance |
syrup |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H32O3 |
| InChI |
InChI=1S/C22H32O3/c1-15-7-8-20-21(3,4)10-6-11-22(20,5)18(15)13-19(25-16(2)23)17-9-12-24-14-17/h7,9,12,14,18-20H,6,8,10-11,13H2,1-5H3/t18-,19-,20-,22+/m0/s1 |
| InChIKey |
JQPHEXBZJLFBIP-BPBCIEFSSA-N |
| Instrument Name |
Hewlett-Packard HP 5989A |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1021/np010590u |
| Molecular Weight |
344.495 g/mol |
| Optical Rotation |
[a]D22 = -32.8 (c = 0.090, CHCl3) |
| SMILES |
C1CC(C)(C)[C@]2([H])CC=C(C)[C@](C[C@@](c3cocc3)(OC(=O)C)[H])([C@@]2(C)C1)[H] |
| SPLASH |
splash10-06r6-5900000000-8633dd11b8ddf0fd9386 |
| Source of Spectrum |
G4-65-666-20 |
| Wiley ID |
1883648 |
