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(1R,2S)-(+)-1-[(3-tert-Butyl-2-hydroxy-5-methoxybenzylidene)amino]indan-2-ol
SpectraBase Compound ID I66edmKmA5v
InChI InChI=1S/C21H25NO3/c1-21(2,3)17-11-15(25-4)9-14(20(17)24)12-22-19-16-8-6-5-7-13(16)10-18(19)23/h5-9,11-12,18-19,23-24H,10H2,1-4H3/b22-12+/t18-,19+/m0/s1
InChIKey NPLWUBXOYLBYML-VWVGJFTFSA-N
Mol Weight 339.44 g/mol
Molecular Formula C21H25NO3
Exact Mass 339.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2vO5pGiuEy
Name (1R,2S)-(+)-1-[(3-tert-Butyl-2-hydroxy-5-methoxybenzylidene)amino]indan-2-ol
Alternate Name(s) (1R,2S)-1-{[(E)-(3-tert-butyl-2-hydroxy-5-methoxyphenyl)methylidene]amino}-2,3-dihydro-1H-inden-2-ol
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Formula C21H25NO3
InChI InChI=1S/C21H25NO3/c1-21(2,3)17-11-15(25-4)9-14(20(17)24)12-22-19-16-8-6-5-7-13(16)10-18(19)23/h5-9,11-12,18-19,23-24H,10H2,1-4H3/b22-12+/t18-,19+/m0/s1
InChIKey NPLWUBXOYLBYML-VWVGJFTFSA-N
Molecular Weight 339.435 g/mol
SMILES O[C@]1(Cc2c([C@]1(\N=C\c1cc(cc(c1O)C(C)(C)C)OC)[H])cccc2)[H]
SPLASH splash10-053f-7913000000-8b06e8399664661c6517
Source of Spectrum KD-16-1172-15
Wiley ID 1637593