| SpectraBase Spectrum ID |
FvCdr862uX |
| Name |
Benzylpenicilline artifact-2 (ME) |
| Classification |
Antibiotic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
207.089543280 u |
| Formula |
C11H13NO3 |
| InChI |
InChI=1S/C11H13NO3/c1-15-11(14)8-12-10(13)7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,12,13) |
| InChIKey |
VISLHUSQBAQEBB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
207.229 g/mol |
| Related CAS Registry Number(s) |
61-33-6 |
| SMILES |
c1cccc(CC(NCC(OC)=O)=O)c1 |
| SPLASH |
splash10-0006-9100000000-c43a0f9d27009585ea7b |
| 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_8356 |
