| SpectraBase Spectrum ID |
GsMVJEKF864 |
| Name |
4-Methylhexanal |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
114.104465070 u |
| Formula |
C7H14O |
| InChI |
InChI=1S/C7H14O/c1-3-7(2)5-4-6-8/h6-7H,3-5H2,1-2H3 |
| InChIKey |
GIGNTOMJQYNUNL-UHFFFAOYSA-N |
| Instrument Name |
Agilent 6890-5973N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jsfa.4205 |
| Molecular Weight |
114.188 g/mol |
| Number of Peaks |
10 |
| SMILES |
CCC(CCC=O)C |
| SPLASH |
splash10-05fu-9000000000-f1ebe4184a0620eda167 |
| Source of Spectrum |
SFA-91-454-4-Methylhexanal (DOI: 10.1002/jsfa.4205) |
| Wiley ID |
1838664 |
