| SpectraBase Spectrum ID |
FkH76Nsb8xa |
| Name |
Hexenal |
| CAS Registry Number |
51795-75-6 |
| 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 |
172.146329882 u |
| Formula |
C10H20O2 |
| InChI |
InChI=1S/C10H20O2/c1-4-7-8-9-10(11-5-2)12-6-3/h7-8,10H,4-6,9H2,1-3H3/b8-7+ |
| InChIKey |
IOBHVJHSBREPFR-BQYQJAHWSA-N |
| Molecular Weight |
172.268 g/mol |
| Number of Peaks |
50 |
| RI1 |
1093 |
| SMILES |
C(C\C=C\CC)(OCC)OCC |
| SPLASH |
splash10-0f92-9300000000-47b120b39aec7c2dcf76 |
| 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-Hexene, 1,1-diethoxy-, |
| Wiley ID |
LM_FFNSC3_2931 |
