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(p-butoxyphenyl)acetic acid, methyl ester
SpectraBase Compound ID 6XuFqCVf0y0
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
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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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