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2-(3-keto-6-methoxy-indan-1-yl)acetic acid

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2-(3-keto-6-methoxy-indan-1-yl)acetic acid
SpectraBase Compound ID DehxILz0A7Y
InChI InChI=1S/C12H12O4/c1-16-8-2-3-9-10(6-8)7(4-11(9)13)5-12(14)15/h2-3,6-7H,4-5H2,1H3,(H,14,15)
InChIKey QOTZOFGBBCMWEP-UHFFFAOYSA-N
Mol Weight 220.22 g/mol
Molecular Formula C12H12O4
Exact Mass 220.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1KgRAvqO1NE
Name 5-Methoxy-1-indanone-3-acetic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 225282
CAS Registry Number 24467-92-3
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O4
InChI InChI=1S/C12H12O4/c1-16-8-2-3-9-10(6-8)7(4-11(9)13)5-12(14)15/h2-3,6-7H,4-5H2,1H3,(H,14,15)
InChIKey QOTZOFGBBCMWEP-UHFFFAOYSA-N
Observed nucleus 13C
Purity Tech.
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 6-Methoxy-3-oxo-1-indanacetic acid
Wiley ID SIAL_13CNMR_003415