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1-CARBOXY-4-METHOXYMETHYL-AZULENE

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1-CARBOXY-4-METHOXYMETHYL-AZULENE
SpectraBase Compound ID JGPKYCIMTeV
InChI InChI=1S/C13H12O3/c1-16-8-9-4-2-3-5-11-10(9)6-7-12(11)13(14)15/h2-7H,8H2,1H3,(H,14,15)
InChIKey UKGQIHIDHDFWNT-UHFFFAOYSA-N
Mol Weight 216.24 g/mol
Molecular Formula C13H12O3
Exact Mass 216.078644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1ZxdvM1DRBM
Name 1-CARBOXY-4-METHOXYMETHYL-AZULENE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H12O3
InChI InChI=1S/C13H12O3/c1-16-8-9-4-2-3-5-11-10(9)6-7-12(11)13(14)15/h2-7H,8H2,1H3,(H,14,15)
InChIKey UKGQIHIDHDFWNT-UHFFFAOYSA-N
Literature Reference Author U.SIEGEL,R.MUES,R.DOENIG,T.EICHER,M.BLECHSCHMIDT,H.BECKER
Literature Reference Citation PHYTOCHEM.,31,1671(1992)
Literature Reference DOI 10.1016/0031-9422(92)83126-J
Molecular Weight 216.236 g/mol
Solvent CDCl3
Source File Reference UWVN5936