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trans-4-Amino-6-cyano-3,4-dihydro-2,2-dimethyl-2H-1-benzopyran-3-ol
SpectraBase Compound ID BkmbnhcAHc4
InChI InChI=1S/C12H14N2O2/c1-12(2)11(15)10(14)8-5-7(6-13)3-4-9(8)16-12/h3-5,10-11,15H,14H2,1-2H3/t10-,11+/m0/s1
InChIKey APHWBGUCQBONMO-WDEREUQCSA-N
Mol Weight 218.26 g/mol
Molecular Formula C12H14N2O2
Exact Mass 218.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ClslSaXwgi
Name trans-4-Amino-6-cyano-3,4-dihydro-2,2-dimethyl-2H-1-benzopyran-3-ol
Alternate Name(s) (3R,4S)-4-amino-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile (3R,4S)-4-amino-3-hydroxy-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile (3R,4S)-4-amino-3-hydroxy-2,2-dimethyl-chroman-6-carbonitrile (3R,4S)-4-amino-3-hydroxy-2,2-dimethyl-chromane-6-carbonitrile (3R,4S)-4-azanyl-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile
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Formula C12H14N2O2
InChI InChI=1S/C12H14N2O2/c1-12(2)11(15)10(14)8-5-7(6-13)3-4-9(8)16-12/h3-5,10-11,15H,14H2,1-2H3/t10-,11+/m0/s1
InChIKey APHWBGUCQBONMO-WDEREUQCSA-N
Molecular Weight 218.256 g/mol
SMILES O[C@]1(C(Oc2c([C@@]1(N)[H])cc(cc2)C#N)(C)C)[H]
SPLASH splash10-0002-1900000000-7c8a05aac672f8385376
Source of Spectrum O-20-441-3
Wiley ID 1217565