| SpectraBase Spectrum ID |
EDIqcTSAwFh |
| Name |
Tiglate |
| CAS Registry Number |
7785-66-2 |
| 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 |
156.115029753 u |
| Formula |
C9H16O2 |
| InChI |
InChI=1S/C9H16O2/c1-4-6-7-11-9(10)8(3)5-2/h5H,4,6-7H2,1-3H3/b8-5+ |
| InChIKey |
RBGFLIOXJWFKKX-VMPITWQZSA-N |
| Molecular Weight |
156.225 g/mol |
| Number of Peaks |
50 |
| RI1 |
1133 |
| RI2 |
810 |
| RI3 |
831 |
| RI4 |
786 |
| RI5 |
1119 |
| SMILES |
C\C=C\(C(OCCCC)=O)C |
| SPLASH |
splash10-0pc0-9300000000-59d1db50ea8f111d8cb1 |
| 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-, butyl ester, (2E)- |
| Wiley ID |
LM_FFNSC3_1438 |
