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2-METHOXY-5-(Z)-HEXACENEOIC_ACID
SpectraBase Compound ID CPu3egD5gzg
InChI InChI=1S/C17H32O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(20-2)17(18)19/h12-13,16H,3-11,14-15H2,1-2H3,(H,18,19)/b13-12-
InChIKey IZQFBIOUXQEERU-SEYXRHQNSA-N
Mol Weight 284.4 g/mol
Molecular Formula C17H32O3
Exact Mass 284.235145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8jyUsxQVh0M
Name 2-METHOXY-5-(Z)-HEXACENEOIC_ACID
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H32O3
InChI InChI=1S/C17H32O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(20-2)17(18)19/h12-13,16H,3-11,14-15H2,1-2H3,(H,18,19)/b13-12-
InChIKey IZQFBIOUXQEERU-SEYXRHQNSA-N
Literature Reference Author N.M.CARBALLEIRA,A.EMILIANO,N.HERNANDEZ-ALONSO,F.A.GONZALEZ
Literature Reference Citation J.NAT.PROD.,61,1543(1998)
Literature Reference DOI 10.1021/np980274o
Molecular Weight 284.439 g/mol
Solvent CDCl3
Source File Reference UWMZ881