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(3AR*,7S*,7AR*)-CIS-7-METHYLHEXAHYDROBENZO-[F]-4-ONE
SpectraBase Compound ID D3rPT9Xs6fy
InChI InChI=1S/C14H16O/c1-9-10-5-2-3-6-12(10)14(15)13-8-4-7-11(9)13/h2-3,5-6,9,11,13H,4,7-8H2,1H3/t9-,11?,13?/m1/s1
InChIKey JKVUJXMDWPHXQS-CBZQXFMTSA-N
Mol Weight 200.28 g/mol
Molecular Formula C14H16O
Exact Mass 200.120115 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JrJM9tb2x8s
Name (3AR*,7S*,7AR*)-CIS-7-METHYLHEXAHYDROBENZO-[F]-4-ONE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H16O
InChI InChI=1S/C14H16O/c1-9-10-5-2-3-6-12(10)14(15)13-8-4-7-11(9)13/h2-3,5-6,9,11,13H,4,7-8H2,1H3/t9-,11?,13?/m1/s1
InChIKey JKVUJXMDWPHXQS-CBZQXFMTSA-N
Literature Reference Author L.ACKERMANN,A.HEIDBREDER,F.WURCHE,F.G.KLAERNER,J.MATTAY
Literature Reference Citation J.CHEM.SOC.PERKIN-2,863(1999)
Literature Reference DOI 10.1039/a807683i
Molecular Weight 200.280 g/mol
Solvent CDCl3
Source File Reference UWRU10330