| SpectraBase Spectrum ID |
G5UPcahjDsh |
| Name |
Hex-(3E)-enoate |
| Source of Sample |
SAFC Cat.no. W334200 |
| CAS Registry Number |
2396-83-0 |
| 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 |
142.099379689 u |
| Formula |
C8H14O2 |
| InChI |
InChI=1S/C8H14O2/c1-3-5-6-7-8(9)10-4-2/h5-6H,3-4,7H2,1-2H3/b6-5+ |
| InChIKey |
VTSFIPHRNAESED-AATRIKPKSA-N |
| Molecular Weight |
142.198 g/mol |
| Number of Peaks |
50 |
| RI1 |
1008 |
| RI2 |
678 |
| RI3 |
712 |
| RI4 |
667 |
| SMILES |
CC\C=C\CC(OCC)=O |
| SPLASH |
splash10-014l-9000000000-0a1df3539af457f23903 |
| 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-Hexenoic acid, ethyl ester |
| Wiley ID |
LM_FFNSC3_332 |
