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(4RS,4ASR,10BRS)-4A,10B-DIHYDRO-2-METHYL-4-PHENYL-1-PHENYLSULFINYL-4H,5H-PYRANO-[3,4-C]-[1]-BENZOPYRAN
SpectraBase Compound ID 3qXMJADWb4p
InChI InChI=1S/C25H22O3S/c1-17-25(29(26)19-12-6-3-7-13-19)23-20-14-8-9-15-22(20)27-16-21(23)24(28-17)18-10-4-2-5-11-18/h2-15,21,23-24H,16H2,1H3/t21-,23+,24+,29?/m0/s1
InChIKey MCCOHUDZKHRXHW-NXOHCDPASA-N
Mol Weight 402.51 g/mol
Molecular Formula C25H22O3S
Exact Mass 402.128966 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HyWdpYYw4VS
Name (4RS,4ASR,10BRS)-4A,10B-DIHYDRO-2-METHYL-4-PHENYL-1-PHENYLSULFINYL-4H,5H-PYRANO-[3,4-C]-[1]-BENZOPYRAN
Compound Number CIS-18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H22O3S
InChI InChI=1S/C25H22O3S/c1-17-25(29(26)19-12-6-3-7-13-19)23-20-14-8-9-15-22(20)27-16-21(23)24(28-17)18-10-4-2-5-11-18/h2-15,21,23-24H,16H2,1H3/t21-,23+,24+,29?/m0/s1
InChIKey MCCOHUDZKHRXHW-NXOHCDPASA-N
Literature Reference Author K.BOGDANOWICY-SZWED,A.PALASZ
Literature Reference Citation MH.CHEM.,132,393(2001)
Literature Reference DOI 10.1007/s007060170125
Molecular Weight 402.508 g/mol
Solvent CDCl3
Source File Reference UWSI3208