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Isopimpinellin

View entire compound with spectra: 27 NMR, 1 FTIR, 1 Raman, and 13 MS (GC)

Isopimpinellin
SpectraBase Compound ID 6NPEEkAIod1
InChI InChI=1S/C13H10O5/c1-15-10-7-3-4-9(14)18-12(7)13(16-2)11-8(10)5-6-17-11/h3-6H,1-2H3
InChIKey DFMAXQKDIGCMTL-UHFFFAOYSA-N
Mol Weight 246.22 g/mol
Molecular Formula C13H10O5
Exact Mass 246.052823 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 578cG9TrO6y
Name ISOPIMPINELLIN
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H10O5
InChI InChI=1S/C13H10O5/c1-15-10-7-3-4-9(14)18-12(7)13(16-2)11-8(10)5-6-17-11/h3-6H,1-2H3
InChIKey DFMAXQKDIGCMTL-UHFFFAOYSA-N
Literature Reference Author Y.A.KIM,C.S.KONG,H.H.PARK,E.LEE,M.S.JANG,K.H.NAM,Y.SEO
Literature Reference Citation MOLECULES,20,14474(2015)
Literature Reference DOI 10.3390/molecules200814474
Molecular Weight 246.219 g/mol
Solvent CDCl3
Source File Reference UWPA5004