(S)-Carprofen

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Systematic / IUPAC Name: (2S)-2-(6-Chloro-9H-carbazol-2-yl)propanoic acid

ID: Reference7211

Other Names: (+)-Carprofen;
(S)-(+)-Carprofen;
(S)-2-(3-Chloro-9H-carbazol-7-yl)propanoic acid;
(S)-2-(6-Chloro-9H-carbazol-2-yl)-propionic acid;
(S)-6-Chloro-α-methylcarbazole-2-acetic acid

Formula: C15H12ClNO2

Class: Therapeutics/Prescription Drugs Sports Doping Drugs

Spectral Data

(S)-Carprofen mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 86
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 1/4/2018 6:13:07 AM
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Identificators

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)/t8-/m0/s1
InChI Key PUXBGTOOZJQSKH-QMMMGPOBSA-N
Canonical SMILES CC(C1=CC2=C(C=C1)C3=C(N2)C=CC(=C3)Cl)C(=O)O
CAS 53716497
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Other Names (+)-Carprofen;
(S)-(+)-Carprofen;
(S)-2-(3-Chloro-9H-carbazol-7-yl)propanoic acid;
(S)-2-(6-Chloro-9H-carbazol-2-yl)-propionic acid;
(S)-6-Chloro-α-methylcarbazole-2-acetic acid

In Other Databases

Wikipedia Carprofen
ChEMBL CHEMBL1316; CHEMBL2171249
DrugBank DB00821
ChemIDPlus 053716497; 052263475
KEGG D03410; C18364
ChemSpider 581047
HMDb HMDB14959
ChEBI CHEBI:364453; CHEBI:59207
PubChem 667685