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1-[(3R,4S)-2,2-dimethyl-3-oxidanyl-4-(propan-2-ylamino)-3,4-dihydrochromen-6-yl]ethanone
SpectraBase Compound ID 9oopX1x2Ba5
InChI InChI=1S/C16H23NO3/c1-9(2)17-14-12-8-11(10(3)18)6-7-13(12)20-16(4,5)15(14)19/h6-9,14-15,17,19H,1-5H3/t14-,15+/m0/s1
InChIKey CSTVRVLCNLYBKP-LSDHHAIUSA-N
Mol Weight 277.36 g/mol
Molecular Formula C16H23NO3
Exact Mass 277.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HdKuFBlkO7O
Name 1-[(3R,4S)-2,2-dimethyl-3-oxidanyl-4-(propan-2-ylamino)-3,4-dihydrochromen-6-yl]ethanone
Alternate Name(s) 1-[(3R,4S)-3-hydroxy-2,2-dimethyl-4-(propan-2-ylamino)-3,4-dihydro-2H-1-benzopyran-6-yl]ethanone 1-[(3R,4S)-3-hydroxy-2,2-dimethyl-4-(propan-2-ylamino)-3,4-dihydrochromen-6-yl]ethanone 1-[(3R,4S)-3-hydroxy-4-(isopropylamino)-2,2-dimethyl-chroman-6-yl]ethanone
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Formula C16H23NO3
InChI InChI=1S/C16H23NO3/c1-9(2)17-14-12-8-11(10(3)18)6-7-13(12)20-16(4,5)15(14)19/h6-9,14-15,17,19H,1-5H3/t14-,15+/m0/s1
InChIKey CSTVRVLCNLYBKP-LSDHHAIUSA-N
Molecular Weight 277.364 g/mol
SMILES O[C@]1(C(Oc2c([C@@]1(NC(C)C)[H])cc(cc2)C(=O)C)(C)C)[H]
SPLASH splash10-052f-6890000000-b86d35c34a77024bc6d4
Source of Spectrum O-20-441-16
Wiley ID 1281103