| SpectraBase Spectrum ID |
LrWCfJjOCV8 |
| Name |
Butyl tiglate, 2-methyl-1 |
| CAS Registry Number |
61692-80-6 |
| 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 |
170.130679818 u |
| Formula |
C10H18O2 |
| InChI |
InChI=1S/C10H18O2/c1-5-8(3)7-12-10(11)9(4)6-2/h6,8H,5,7H2,1-4H3/b9-6+ |
| InChIKey |
DEJJNOHKWLTTKE-RMKNXTFCSA-N |
| Molecular Weight |
170.252 g/mol |
| Number of Peaks |
31 |
| RI1 |
1195 |
| RI2 |
873 |
| RI3 |
879 |
| RI4 |
835 |
| RI5 |
1179 |
| SMILES |
C\C(C(=O)OCC(CC)C)=C/C |
| SPLASH |
splash10-05al-9000000000-88ac08876a0c3307e9aa |
| 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-, 2-methylbutyl ester, (2E)- |
| Wiley ID |
LM_FFNSC3_3406 |
