| SpectraBase Spectrum ID |
I5tHI7nhIYf |
| Name |
Myrtenyl tiglate |
| CAS Registry Number |
1231959-57-1 |
| 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 |
234.161979946 u |
| Formula |
C15H22O2 |
| InChI |
InChI=1S/C15H22O2/c1-5-10(2)14(16)17-9-11-6-7-12-8-13(11)15(12,3)4/h5-6,12-13H,7-9H2,1-4H3/b10-5+ |
| InChIKey |
NVDMRTRSCKSXHT-BJMVGYQFSA-N |
| Molecular Weight |
234.339 g/mol |
| Number of Peaks |
50 |
| RI1 |
1650 |
| RI2 |
1329 |
| RI3 |
1447 |
| RI4 |
1407 |
| RI5 |
1632 |
| SMILES |
C\C(C(=O)OCC=1C2C(C(CC1)C2)(C)C)=C/C |
| SPLASH |
splash10-0006-9300000000-4ab6ca1056782b1fd59d |
| 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 |
2-Butenoic acid, 2-methyl-, (6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl)methyl ester, (2E)- |
| Wiley ID |
LM_FFNSC3_3403 |
