| SpectraBase Spectrum ID |
Ld9yZ5GkJFV |
| Name |
3-Cyclohexene-1-ethanol, .alpha.-(3,7-dimethyl-2,6-octadienyl)-.beta.,4-dimethyl-, [1S-[1R*[.alpha.S*(Z),.beta.R*]]]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
290.260965714 u |
| Formula |
C20H34O |
| InChI |
InChI=1S/C20H34O/c1-15(2)7-6-8-16(3)11-14-20(21)18(5)19-12-9-17(4)10-13-19/h7,9,11,18-21H,6,8,10,12-14H2,1-5H3/b16-11+/t18-,19+,20-/m1/s1 |
| InChIKey |
PPIFSRYXRDEWGM-BQDICAAFSA-N |
| SMILES |
C1=C(CC[C@@]([C@]([C@@](C\C=C\(CCC=C(C)C)C)(O)[H])(C)[H])(C1)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92439 |
![3-Cyclohexene-1-ethanol, .alpha.-(3,7-dimethyl-2,6-octadienyl)-.beta.,4-dimethyl-, [1S-[1R*[.alpha.S*(Z),.beta.R*]]]-](/api/spectrum/Ld9yZ5GkJFV/structure.png?h=300&w=458 "3-Cyclohexene-1-ethanol, .alpha.-(3,7-dimethyl-2,6-octadienyl)-.beta.,4-dimethyl-, [1S-[1R*[.alpha.S*(Z),.beta.R*]]]-")
