SpectraBase Spectrum ID |
cpAkTwy5hI |
Name |
Propicillin artifact-2 |
Classification |
Antibiotic |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
251.115758027 u |
Formula |
C13H17NO4 |
InChI |
InChI=1S/C13H17NO4/c1-3-11(13(16)14-9-12(15)17-2)18-10-7-5-4-6-8-10/h4-8,11H,3,9H2,1-2H3,(H,14,16) |
InChIKey |
PQOMRBGNKHFPMZ-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
251.282 g/mol |
Related CAS Registry Number(s) |
551-27-9 |
SMILES |
C(=O)(NCC(OC)=O)C(Oc1ccccc1)CC |
SPLASH |
splash10-0ar9-9300000000-3ce0a1576c773811f252 |
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_8466 |