CP-634384

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Systematic / IUPAC Name: 2-{4-[(7-Hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-3,5-dimethylanilino}-2-oxoacetic acid

ID: Reference2809

Other Names: Acetic acid, 2-({4-[(2,3-dihydro-7-hydroxy-1H-inden-4-yl)oxy]-3,5-dimethylphenyl}amino)-2-oxo-

Formula: C19H19NO5

Spectral Data

CP-634384 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 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 6/16/2015 12:35:51 PM
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Identificators

InChI InChI=1S/C19H19NO5/c1-10-8-12(20-18(22)19(23)24)9-11(2)17(10)25-16-7-6-15(21)13-4-3-5-14(13)16/h6-9,21H,3-5H2,1-2H3,(H,20,22)(H,23,24)
InChI Key CEYPDXWCYTVSDN-UHFFFAOYSA-N
Canonical SMILES CC1=CC(=CC(=C1OC2=C3CCCC3=C(C=C2)O)C)NC(=O)C(=O)O
CAS 290352282
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Other Names Acetic acid, 2-({4-[(2,3-dihydro-7-hydroxy-1H-inden-4-yl)oxy]-3,5-dimethylphenyl}amino)-2-oxo-

In Other Databases

ChemSpider 7995099
PubChem 9819350
ChEMBL CHEMBL608990