| SpectraBase Spectrum ID |
GQzwD5819YU |
| Name |
Hexanoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
116.083729624 u |
| Formula |
C6H12O2 |
| GC Column |
HP-INNOWAX (20 m x 0.18 mm, film thickness 0.18 micrometer) |
| GC Oven Program |
Oven temp 250oC |
| InChI |
InChI=1S/C6H12O2/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H,7,8) |
| InChIKey |
FUZZWVXGSFPDMH-UHFFFAOYSA-N |
| Inlet Type |
Split (50:1) |
| Instrument Name |
Agilent GC-MS 7890A-5975C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202306621 |
| Molecular Weight |
116.160 g/mol |
| Quality |
960 |
| SMILES |
OC(CCCCC)=O |
| SPLASH |
splash10-03kc-9000000000-9748a631ca3292fe1a00 |
| Source of Spectrum |
ACI-62-SM22-Figure S37-a (DOI: 10.1002/anie.202306621) |
| Wiley ID |
1911179 |
