| SpectraBase Spectrum ID |
KgBBDx3bK0A |
| Name |
1-(o-Tolyl)pentan-1-one |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
176.120115134 u |
| Formula |
C12H16O |
| InChI |
InChI=1S/C12H16O/c1-3-4-9-12(13)11-8-6-5-7-10(11)2/h5-8H,3-4,9H2,1-2H3 |
| InChIKey |
BCMBDNBMSRGBHF-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu QP 1000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202004840 |
| Molecular Weight |
176.259 g/mol |
| Quality |
227 |
| SMILES |
C=1C=CC=C(C(=O)CCCC)C1C |
| SPLASH |
splash10-014i-3900000000-f79f52906c04dec6869e |
| Source of Spectrum |
QE-27-SM33-2m (DOI: 10.1002/chem.202004840) |
| Thin-Layer Chromatography |
0.37 (hexane/EtOAc, 95:5) |
| Wiley ID |
1902311 |
