| SpectraBase Spectrum ID |
B0aptPOfP95 |
| Name |
4-[(1R,2R,4aS,8aS)-2-hydroxy-2,5,5,8a-tetramethyl-decalin-1-yl]-2-methylene-butanal |
| Appearance |
Pale yellow gum |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H32O2 |
| InChI |
InChI=1S/C19H32O2/c1-14(13-20)7-8-16-18(4)11-6-10-17(2,3)15(18)9-12-19(16,5)21/h13,15-16,21H,1,6-12H2,2-5H3/t15-,16+,18-,19+/m0/s1 |
| InChIKey |
XVEFWGFYWHWODE-OGWHTMIXSA-N |
| Instrument Name |
JEOL JMS-AX505HA |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np500688c |
| Molecular Weight |
292.463 g/mol |
| Optical Rotation |
[a]D20 = -6 (c = 0.1, CHCl3) |
| SMILES |
O[C@]1([C@@]([C@]2(CCCC([C@@]2(CC1)[H])(C)C)C)(CCC(C=O)=C)[H])C |
| SPLASH |
splash10-052f-9510000000-243c5c786fe8d2d1bd59 |
| Source of Spectrum |
G4-78-206-5 |
| Wiley ID |
1865836 |
![4-[(1R,2R,4aS,8aS)-2-hydroxy-2,5,5,8a-tetramethyl-decalin-1-yl]-2-methylene-butanal](/api/spectrum/B0aptPOfP95/structure.png?h=300&w=458 "4-[(1R,2R,4aS,8aS)-2-hydroxy-2,5,5,8a-tetramethyl-decalin-1-yl]-2-methylene-butanal")
