| SpectraBase Spectrum ID |
I2FC5rsslEu |
| Name |
Paracetamol-D4 HFB |
| Classification |
Internal standard
Analgesic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
351.064347243 u |
| Formula |
C12H4D4F7NO3 |
| InChI |
InChI=1S/C12H8F7NO3/c1-6(21)20-7-2-4-8(5-3-7)23-9(22)10(13,14)11(15,16)12(17,18)19/h2-5H,1H3,(H,20,21)/i2D,3D,4D,5D |
| InChIKey |
BONJYQQQOFCHPC-QFFDRWTDSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
351.213 g/mol |
| SMILES |
C(C(C(C(=O)Oc1c(c([D])c(c(c1[D])[D])NC(C)=O)[D])(F)F)(F)F)(F)(F)F |
| SPLASH |
splash10-03di-6903000000-152160a718abbbc6880c |
| 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. |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_6552 |
