| SpectraBase Spectrum ID |
2oRhAquxpfU |
| Name |
1-(4-Chlorophenyl)ethan-1-one |
| CAS Registry Number |
99-91-2 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (two 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 |
154.018542544 u |
| Formula |
C8H7ClO |
| InChI |
InChI=1S/C8H7ClO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1H3 |
| InChIKey |
BUZYGTVTZYSBCU-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
154.596 g/mol |
| Nominal Mass |
154 u |
| Quality |
991 |
| Retention Index |
1202 |
| SMILES |
C1(C(=O)C)=CC=C(C=C1)Cl |
| SPLASH |
splash10-01p9-3900000000-ee6ab8463301567c5d2e |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Ethanone,1-(4-chlorophenyl)-
1-(4-Chlorophenyl)ethanone |
| Technique |
GC/MS |
| Wiley ID |
DD2024_024340 |
