| SpectraBase Spectrum ID |
DWro1nkM6Kx |
| Name |
Hex-3-enal |
| CAS Registry Number |
6789-80-6 |
| 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 |
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-ARJAWSKDSA-N |
| Molecular Weight |
98.145 g/mol |
| Number of Peaks |
49 |
| RI1 |
797 |
| RI2 |
452 |
| SMILES |
C(\C=C/CC)C=O |
| SPLASH |
splash10-0006-9000000000-b11aef2c76160ed9543e |
| 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-Hexenal, (3Z)- |
| Wiley ID |
LM_FFNSC3_1424 |
