| SpectraBase Spectrum ID |
86NmgPZozIE |
| Name |
methyl 2-(3-(4-chlorophenyl)-3-oxopropyl)-6-methylbenzoate |
| Appearance |
Colorless liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
316.086622104 u |
| Formula |
C18H17ClO3 |
| GC Column |
HP-5 |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C18H17ClO3/c1-12-4-3-5-14(17(12)18(21)22-2)8-11-16(20)13-6-9-15(19)10-7-13/h3-7,9-10H,8,11H2,1-2H3 |
| InChIKey |
KHODHJOFXJILHQ-UHFFFAOYSA-N |
| Instrument Name |
Agilent GC-MS 5977B MSD |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201800757 |
| Molecular Weight |
316.784 g/mol |
| Quality |
23 |
| Reported Formula |
C18H17ClO3 |
| SMILES |
COC(C1=C(C=CC=C1C)CCC(=O)C1=CC=C(C=C1)Cl)=O |
| SPLASH |
splash10-000i-0900000000-d835423dbfccd6dd2fa4 |
| Source of Spectrum |
QE-24-SM20-3af (DOI: 10.1002/chem.201800757) |
| Wiley ID |
1900132 |
