| SpectraBase Spectrum ID |
1Lm6eLGiquS |
| Name |
But-3-en-2-ol <4-(2,6,6-trimethyl-, 2-cyclohexen-1-yl)-> acetate |
| CAS Registry Number |
52210-18-1 |
| 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 |
236.177630011 u |
| Formula |
C15H24O2 |
| InChI |
InChI=1S/C15H24O2/c1-11-7-6-10-15(4,5)14(11)9-8-12(2)17-13(3)16/h7-9,12,14H,6,10H2,1-5H3/b9-8+ |
| InChIKey |
WHHAWKIPTSGTNC-CMDGGOBGSA-N |
| Molecular Weight |
236.355 g/mol |
| Number of Peaks |
50 |
| RI1 |
1490 |
| RI2 |
1168 |
| RI3 |
1202 |
| RI4 |
1163 |
| SMILES |
C1CC=C(C(C1(C)C)\C=C\C(C)OC(C)=O)C |
| SPLASH |
splash10-0006-9800000000-a2865ab6cab9ce4ad19a |
| 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 |
3-Buten-2-ol, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, acetate |
| Wiley ID |
LM_FFNSC3_1367 |
