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Ibuprofen-M (CO2) 2ME
SpectraBase Compound ID 68G1C2coJNV
InChI InChI=1S/C15H20O4/c1-10(14(16)18-3)9-12-5-7-13(8-6-12)11(2)15(17)19-4/h5-8,10-11H,9H2,1-4H3
InChIKey HWGFJGIDJHBXPQ-UHFFFAOYSA-N
Mol Weight 264.32 g/mol
Molecular Formula C15H20O4
Exact Mass 264.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BazvDgjzK70
Name Ibuprofen-M (HOOC-) 2ME
Classification Analgesic
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Exact Mass 264.136159120 u
Formula C15H20O4
InChI InChI=1S/C15H20O4/c1-10(14(16)18-3)9-12-5-7-13(8-6-12)11(2)15(17)19-4/h5-8,10-11H,9H2,1-4H3
InChIKey HWGFJGIDJHBXPQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 264.321 g/mol
SMILES c1c(ccc(c1)C(C)C(=O)OC)CC(C(=O)OC)C
SPLASH splash10-0ar1-1950000000-e35c0d6336f859be7162
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.
Sample Preparation Procedure Detected: UME
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_3384