| SpectraBase Spectrum ID |
6IMYTuRb4RW |
| Name |
Prop-1'-en-1'-ol,2-[octahydro-3a',7a'-dimethyl-4',7'-methano-1'H-1'-yl-(1'alpha,3a'alpha,4'beta,7'beta,7a'alpha)]-acetate |
| Classification |
Iridoids and derivatives |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
262.193280075 u |
| Formula |
C17H26O2 |
| InChI |
InChI=1S/C17H26O2/c1-11(10-19-12(2)18)15-7-8-16(3)13-5-6-14(9-13)17(15,16)4/h10,13-15H,5-9H2,1-4H3/b11-10+/t13-,14+,15+,16+,17+/m0/s1 |
| InChIKey |
AWTDHJFBDJMMHR-UGXGUJROSA-N |
| Molecular Weight |
262.393 g/mol |
| Number of Peaks |
19 |
| SMILES |
[C@@]12([C@]3(CC[C@@]([C@@]2([C@@](\C(C)=C\OC(C)=O)(CC1)[H])C)(C3)[H])[H])C |
| SPLASH |
splash10-00ec-9500000000-4824d5f812ca35fd25f1 |
| Source of Spectrum |
FF-10-215-10 (DOI: 10.1002/ffj.2730100315) |
| Synonyms |
(E)-2-((1S,3aR,4S,7R,7aR)-3a,7a-dimethyloctahydro-1H-4,7-methanoinden-1-yl)prop-1-en-1-yl acetate |
| Wiley ID |
1801300 |
![Prop-1'-en-1'-ol,2-[octahydro-3a',7a'-dimethyl-4',7'-methano-1'H-1'-yl-(1'alpha,3a'alpha,4'beta,7'beta,7a'alpha)]-acetate](/api/spectrum/6IMYTuRb4RW/structure.png?h=300&w=458 "Prop-1'-en-1'-ol,2-[octahydro-3a',7a'-dimethyl-4',7'-methano-1'H-1'-yl-(1'alpha,3a'alpha,4'beta,7'beta,7a'alpha)]-acetate")
