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Carprofen
SpectraBase Compound ID EszLQ6kmTvK
InChI InChI=1S/C15H12ClNO2/c1-8(15(18)19)9-2-4-11-12-7-10(16)3-5-13(12)17-14(11)6-9/h2-8,17H,1H3,(H,18,19)
InChIKey PUXBGTOOZJQSKH-UHFFFAOYSA-N
Mol Weight 273.72 g/mol
Molecular Formula C15H12ClNO2
Exact Mass 273.055656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4kGly1lAGW
Name Carprofen
CAS Registry Number 53716-49-7
Classification Analgesic
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Exact Mass 273.055656328 u
Formula C15H12ClNO2
InChI InChI=1S/C15H12ClNO2/c1-8(15(18)19)9-2-4-11-12-7-10(16)3-5-13(12)17-14(11)6-9/h2-8,17H,1H3,(H,18,19)
InChIKey PUXBGTOOZJQSKH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 273.719 g/mol
SMILES c12c([nH]c3c1ccc(c3)C(C)C(O)=O)ccc(Cl)c2
SPLASH splash10-004i-2490000000-fe0e605b9d12fd902803
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_1999