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2-METHOXY-6-(METHYLETHYL)-CYCLOHEPTA-2,4,6-TRIEN-1-ONE;BETA-THUJAPLICIN-METHYLETHER
SpectraBase Compound ID 8n6jCZ95Ndq
InChI InChI=1S/C11H14O2/c1-8(2)9-5-4-6-11(13-3)10(12)7-9/h4-8H,1-3H3
InChIKey DNORQMNGHAZBGW-UHFFFAOYSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IwbVdWb7VDU
Name 2-METHOXY-6-(METHYLETHYL)-CYCLOHEPTA-2,4,6-TRIEN-1-ONE;BETA-THUJAPLICIN-METHYLETHER
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-8(2)9-5-4-6-11(13-3)10(12)7-9/h4-8H,1-3H3
InChIKey DNORQMNGHAZBGW-UHFFFAOYSA-N
Literature Reference Author J.YAMADA,K.FUJITA,K.SAKAI
Literature Reference Citation PHYTOCHEM.,60,447(2002)
Literature Reference DOI 10.1016/S0031-9422(02)00127-9
Molecular Weight 178.231 g/mol
Solvent CDCl3
Source File Reference UWMS1686