| SpectraBase Spectrum ID |
1OhaGweUpeK |
| Name |
3,4-Seco-Trachylobanoic Acid - Methyl Ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H32O2 |
| InChI |
InChI=1S/C21H32O2/c1-13(2)14-6-9-21-11-16-15(20(16,4)12-21)10-17(21)19(14,3)8-7-18(22)23-5/h14-17H,1,6-12H2,2-5H3 |
| InChIKey |
MPBHKLGEOJDYPD-UHFFFAOYSA-N |
| Molecular Weight |
316.485 g/mol |
| SMILES |
C12(C3CC4(C2)C(C(CCC(=O)OC)(C)C(CC4)C(=C)C)CC13)C |
| SPLASH |
splash10-0a4l-3900000000-1ad4118bb7a65e2396d9 |
| Source of Spectrum |
X2-54-1632-6 |
| Wiley ID |
1604275 |
