| SpectraBase Spectrum ID |
8FoNLzQipFo |
| Name |
4-(4-Hydroxyphenyl)butan-2-one |
| CAS Registry Number |
5471-51-2 |
| 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 |
164.083729624 u |
| Formula |
C10H12O2 |
| InChI |
InChI=1S/C10H12O2/c1-8(11)2-3-9-4-6-10(12)7-5-9/h4-7,12H,2-3H2,1H3 |
| InChIKey |
NJGBTKGETPDVIK-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
164.204 g/mol |
| Nominal Mass |
164 u |
| Quality |
988 |
| Retention Index |
1191 |
| SMILES |
OC=1C=CC(=CC1)CCC(=O)C |
| SPLASH |
splash10-0a4l-6900000000-f295f9f89f9e88766da0 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-(4-hydroxyphenyl)butan-2-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007408 |
