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(3'S,8R)-3'-(4-methylphenyl)spiro[6,7-dihydro-5H-benzo[7]annulene-8,2'-oxirane]-9-one
SpectraBase Compound ID QM1sTOb5rQ
InChI InChI=1S/C19H18O2/c1-13-8-10-15(11-9-13)18-19(21-18)12-4-6-14-5-2-3-7-16(14)17(19)20/h2-3,5,7-11,18H,4,6,12H2,1H3/t18-,19-/m0/s1
InChIKey YGWPGDCQINZONS-OALUTQOASA-N
Mol Weight 278.35 g/mol
Molecular Formula C19H18O2
Exact Mass 278.13068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6SMyZwBLnvp
Name (3'S,8R)-3'-(4-methylphenyl)spiro[6,7-dihydro-5H-benzo[7]annulene-8,2'-oxirane]-9-one
Compound Number TRANS-5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18O2
InChI InChI=1S/C19H18O2/c1-13-8-10-15(11-9-13)18-19(21-18)12-4-6-14-5-2-3-7-16(14)17(19)20/h2-3,5,7-11,18H,4,6,12H2,1H3/t18-,19-/m0/s1
InChIKey YGWPGDCQINZONS-OALUTQOASA-N
Literature Reference Author G.TOTH,J.HALASZ,S.BOROS,A.LEVAI,C.NEMES,T.PATONAY
Literature Reference Citation MAGN.RES.CHEM.,34,932(1996)
Literature Reference DOI 10.1002/(sici)1097-458x(199611)34:11<932::aid-omr978>3.0.co;2-3
Molecular Weight 278.351 g/mol
Solvent CDCl3
Source File Reference UWCP474