SpectraBase Spectrum ID |
QwpgXmEa0 |
Name |
Paracetamol Cl-artifact AC @ |
Classification |
Analgesic |
Comments |
Structure comment: Wiggly bond = unknown position of substituent |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
227.034920883 u |
Formula |
C10H10ClNO3 |
InChI |
InChI=1S/C10H10ClNO3/c1-6(13)12-8-3-4-10(9(11)5-8)15-7(2)14/h3-5H,1-2H3,(H,12,13) |
InChIKey |
YSDRYZQCCPSKLU-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
227.647 g/mol |
SMILES |
c1c(c(Cl)cc(NC(=O)C)c1)OC(=O)C |
SPLASH |
splash10-000f-1900000000-b76bc264f518a7f4257e |
Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
Sample Preparation Procedure |
Detected: UHYAC |
Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
Synonyms |
Acetaminophen Cl-artifact AC
Phenacetin-M (deethyl-) Cl-artifact AC |
Technique |
GC/MS |
Wiley ID |
MMPW6e_2993 |