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(+/-)-CIS-9-METHOXY-6A,12A-DIHYDRO-ROTOXEN-12-(6H)-ONE
SpectraBase Compound ID 3S1gbgkn2rk
InChI InChI=1S/C17H14O4/c1-19-10-6-7-12-14(8-10)21-15-9-20-13-5-3-2-4-11(13)16(15)17(12)18/h2-8,15-16H,9H2,1H3/t15-,16+/m0/s1
InChIKey XMTWIAHPZMPASQ-JKSUJKDBSA-N
Mol Weight 282.3 g/mol
Molecular Formula C17H14O4
Exact Mass 282.089209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CtsyZYAy0SZ
Name (+/-)-CIS-9-METHOXY-6A,12A-DIHYDRO-ROTOXEN-12-(6H)-ONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H14O4
InChI InChI=1S/C17H14O4/c1-19-10-6-7-12-14(8-10)21-15-9-20-13-5-3-2-4-11(13)16(15)17(12)18/h2-8,15-16H,9H2,1H3/t15-,16+/m0/s1
InChIKey XMTWIAHPZMPASQ-JKSUJKDBSA-N
Literature Reference Author L.CROMBIE,J.L.JOSEPHS
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2591(1993)
Molecular Weight 282.296 g/mol
Solvent CDCl3
Source File Reference UWRU3480