| SpectraBase Spectrum ID |
8FjapBcAVfc |
| Name |
4-Propylbenzoyl chloride |
| CAS Registry Number |
52710-27-7 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
182.049842673 u |
| Formula |
C10H11ClO |
| InChI |
InChI=1S/C10H11ClO/c1-2-3-8-4-6-9(7-5-8)10(11)12/h4-7H,2-3H2,1H3 |
| InChIKey |
NZYPCJXREKMMCJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
182.650 g/mol |
| Nominal Mass |
182 u |
| Quality |
982 |
| Retention Index |
1399 |
| SMILES |
C1(=CC=C(C=C1)CCC)C(Cl)=O |
| SPLASH |
splash10-0002-5900000000-7dd4dbeb474b1c57e11b |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-propylbenzoyl chloride |
| Technique |
GC/MS |
| Wiley ID |
DD2024_004711 |
