| SpectraBase Spectrum ID |
1aJAYI9E9bn |
| Name |
Angelate |
| CAS Registry Number |
65652-33-7 |
| 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 |
184.146329882 u |
| Formula |
C11H20O2 |
| InChI |
InChI=1S/C11H20O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h5H,4,6-9H2,1-3H3/b10-5- |
| InChIKey |
JTCIUOKKVACNCK-YHYXMXQVSA-N |
| Molecular Weight |
184.279 g/mol |
| Number of Peaks |
50 |
| RI1 |
1283 |
| RI2 |
961 |
| SMILES |
C(COC(=O)\C(=C/C)C)CCCC |
| SPLASH |
splash10-0zfr-9500000000-514eb6cba1e5ba9ec6ac |
| 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-, hexyl ester, (2Z)- |
| Wiley ID |
LM_FFNSC3_1203 |
