| SpectraBase Spectrum ID |
B3t2b9hipqi |
| Name |
2-Heptanone |
| Carrier Gas |
Helium (1 mL/min) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
114.104465070 u |
| Formula |
C7H14O |
| GC Column |
DB-5ms (30 m x 0.25 mm, film thickness 0.25 micrometer) |
| GC Oven Program |
Oven temp 250oC |
| InChI |
InChI=1S/C7H14O/c1-3-4-5-6-7(2)8/h3-6H2,1-2H3 |
| InChIKey |
CATSNJVOTSVZJV-UHFFFAOYSA-N |
| Instrument Name |
Agilent series 7890B |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jafc.1c04415 |
| Molecular Weight |
114.188 g/mol |
| Quality |
459 |
| SMILES |
CC(=O)CCCCC |
| SPLASH |
splash10-052f-9000000000-17e157ec18981e46fb29 |
| Source of Spectrum |
JAFC-70-SM7-7-1 (DOI: 10.1021/acs.jafc.1c04415) |
| Wiley ID |
1911509 |
