| SpectraBase Spectrum ID |
2lV2Ovm4i6S |
| Name |
Paracetamol |
| CAS Registry Number |
103-90-2 |
| Classification |
Pharmaceutical drug, analgesic |
| Comments |
Spectrum verified by crosschecking against external libraries (five 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 |
151.063328532 u |
| Formula |
C8H9NO2 |
| InChI |
InChI=1S/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10) |
| InChIKey |
RZVAJINKPMORJF-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
151.165 g/mol |
| Nominal Mass |
151 u |
| Quality |
998 |
| Retention Index |
1687 |
| SMILES |
OC1=CC=C(NC(=O)C)C=C1 |
| SPLASH |
splash10-0a4i-5900000000-836d2241fafe469567dc |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
APAP
Acetaminophen
NAPAP
P-Acetamidophenol
Parasetamol
N-(4-Hydroxyphenyl)acetamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_032052 |
