| SpectraBase Spectrum ID |
GfoiWwzQfuB |
| Name |
Davanone-2-ol |
| CAS Registry Number |
54783-66-3 |
| 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 |
252.172544630 u |
| Formula |
C15H24O3 |
| InChI |
InChI=1S/C15H24O3/c1-6-15(5)10-8-13(18-15)11(2)12(16)7-9-14(3,4)17/h6-7,9,11,13,17H,1,8,10H2,2-5H3/b9-7+/t11-,13?,15-/m1/s1 |
| InChIKey |
WQUKMIHCFQFPQG-CXPYNZJZSA-N |
| Molecular Weight |
252.354 g/mol |
| Number of Peaks |
50 |
| RI1 |
1718 |
| SMILES |
OC(\C=C\C([C@](C1O[C@](C=C)(CC1)C)(C)[H])=O)(C)C |
| SPLASH |
splash10-0006-9200000000-a3cf977802e73132b235 |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
4-Hepten-3-one, 2-[(2S,5R)-5-ethenyltetrahydro-5-methyl-2-furanyl]-6-hydroxy-6-methyl- |
| Wiley ID |
LM_FFNSC3_2925 |
![4-Hepten-3-one, 2-(5-ethenyltetrahydro-5-methyl-2-furanyl)-6-hydroxy-6-methyl-, [2S-[2.alpha.(2R*,4E),5.alpha.]]-](/api/spectrum/GfoiWwzQfuB/structure.png?h=300&w=458 "4-Hepten-3-one, 2-(5-ethenyltetrahydro-5-methyl-2-furanyl)-6-hydroxy-6-methyl-, [2S-[2.alpha.(2R*,4E),5.alpha.]]-")
