SpectraBase Spectrum ID |
3r1GsG3YFk |
Name |
Bufexamac-M/artifact (HOOC-) ME |
Classification |
Antirheumatic |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
222.125594437 u |
Formula |
C13H18O3 |
InChI |
InChI=1S/C13H18O3/c1-3-4-9-16-12-7-5-11(6-8-12)10-13(14)15-2/h5-8H,3-4,9-10H2,1-2H3 |
InChIKey |
IEPLOMKGNGXJAW-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
222.284 g/mol |
SMILES |
c1c(OCCCC)ccc(c1)CC(=O)OC |
SPLASH |
splash10-0a4i-7910000000-1e371ee401d700634dfd |
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_6085 |