Nabumetone metabolite

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Systematic / IUPAC Name: 2-(6-Methoxynaphthalen-2-yl)acetic acid

ID: Reference7338

Other Names: α-Demethylnaproxen;
(6-Methoxy-2-naphthyl)acetic acid;
(6-Methoxynaphthalen-2-yl)acetic acid;
2-(6-Methoxy-2-naphthyl)acetic acid;
2-(6-Methoxynaphthalen-2-yl)aceticacid ; more

Formula: C13H12O3

Class: Therapeutics/Prescription Drugs Sports Doping Drugs

Spectral Data

Nabumetone metabolite mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 493
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/6/2018 7:04:34 AM
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Identificators

InChI InChI=1S/C13H12O3/c1-16-12-5-4-10-6-9(7-13(14)15)2-3-11(10)8-12/h2-6,8H,7H2,1H3,(H,14,15)
InChI Key PHJFLPMVEFKEPL-UHFFFAOYSA-N
Canonical SMILES COC1=CC2=C(C=C1)C=C(C=C2)CC(=O)O
CAS 3981477
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Other Names α-Demethylnaproxen;
(6-Methoxy-2-naphthyl)acetic acid;
(6-Methoxynaphthalen-2-yl)acetic acid;
2-(6-Methoxy-2-naphthyl)acetic acid;
2-(6-Methoxynaphthalen-2-yl)aceticacid;
2-(6-Methoxynaphthalen-2-yl)ethanoic acid;
2-Naphthaleneacetic acid, 6-methoxy-;
6-Methoxy-2-naphthaleneacetic acid;
6-Methoxy-2-naphthylacetic acid;
6-Methoxynaphth-2-ylacetic acid;
6-Methoxynaphthalene-2-acetic acid;
6-MNAA

In Other Databases

ChemIDPlus 023981477
ChemSpider 29843
ChEBI CHEBI:35628
ChEMBL CHEMBL1105
PubChem 32176