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(-)-1-methoxy-3-(methyl-tosyl-amino)-6,6,9-trimethyl-6a,10a-trans-6a,7,10,70a-tetrahydro-6H-dibenzo[b,d]pyran
SpectraBase Compound ID CLAyQZiTa3W
InChI InChI=1S/C25H31NO4S/c1-16-7-10-19(11-8-16)31(27,28)26(5)18-14-22(29-6)24-20-13-17(2)9-12-21(20)25(3,4)30-23(24)15-18/h7-11,14-15,20-21H,12-13H2,1-6H3/t20-,21-/m1/s1
InChIKey VEDOIMZBAXEEEG-NHCUHLMSSA-N
Mol Weight 441.59 g/mol
Molecular Formula C25H31NO4S
Exact Mass 441.19738 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JJALCgd9dGK
Name (-)-1-methoxy-3-(methyl-tosyl-amino)-6,6,9-trimethyl-6a,10a-trans-6a,7,10,70a-tetrahydro-6H-dibenzo[b,d]pyran
Alternate Name(s) N-((6aR,10aR)-1-methoxy-6,6,9-trimethyl-6a,7,10,10a-tetrahydro-6H-benzo[c]chromen-3-yl)-N,4-dimethylbenzenesulfonamide
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Formula C25H31NO4S
InChI InChI=1S/C25H31NO4S/c1-16-7-10-19(11-8-16)31(27,28)26(5)18-14-22(29-6)24-20-13-17(2)9-12-21(20)25(3,4)30-23(24)15-18/h7-11,14-15,20-21H,12-13H2,1-6H3/t20-,21-/m1/s1
InChIKey VEDOIMZBAXEEEG-NHCUHLMSSA-N
Literature Reference DOI 10.1002/hlca.19730560148
Molecular Weight 441.586 g/mol
SMILES c1(N(S(=O)(=O)c2ccc(cc2)C)C)cc2OC(C)(C)[C@@]3(CC=C(C[C@]3(c2c(c1)OC)[H])C)[H]
SPLASH splash10-002o-2296300000-d9727b10a9509fe09fe9
Source of Spectrum H-56-517-10
Wiley ID 1801371