| SpectraBase Spectrum ID |
DXNZfAF6fNP |
| Name |
Hex-(3E)-enal |
| CAS Registry Number |
69112-21-6 |
| Classification |
Fatty aldehydes |
| 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 |
98.073164941 u |
| Formula |
C6H10O |
| InChI |
InChI=1S/C6H10O/c1-2-3-4-5-6-7/h3-4,6H,2,5H2,1H3/b4-3+ |
| InChIKey |
GXANMBISFKBPEX-ONEGZZNKSA-N |
| Molecular Weight |
98.145 g/mol |
| Number of Peaks |
40 |
| RI4 |
797 |
| RI5 |
452 |
| SMILES |
C(C\C=C\CC)=O |
| SPLASH |
splash10-0006-9000000000-a33984b70124cf94d8f4 |
| Sample Comments |
RI1: measured on Equity-1 (Alkanes)
RI2: measured on Supelcowax-10 (FAMEs)
RI3: measured on Supelcowax-10 (FAEEs)
RI4: measured on SLB-5ms (Alkanes)
RI5: measured on SLB-5ms (FAMEs) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
3-Hexenal, (3E)- |
| Wiley ID |
LM_LIPIDS2016_423 |
