| SpectraBase Spectrum ID |
8RjNL1LCgix |
| Name |
2-heptanone |
| 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 |
114.104465070 u |
| Formula |
C7H14O |
| InChI |
InChI=1S/C7H14O/c1-3-4-5-6-7(2)8/h3-6H2,1-2H3 |
| InChIKey |
CATSNJVOTSVZJV-UHFFFAOYSA-N |
| Instrument Name |
Agilent 6890 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jsfa.9900 |
| Molecular Weight |
114.188 g/mol |
| Number of Peaks |
4 |
| SMILES |
CC(=O)CCCCC |
| SPLASH |
splash10-004i-9000000000-546e6ab1b86c5c1ec2a7 |
| Source of Spectrum |
SFA-99-SM3-2-heptanone, 2-Hept (DOI: 10.1002/jsfa.9900) |
| Wiley ID |
1838706 |
