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(3S)-3-[(1S)-1-amino-3-methyl-butyl]-8-methoxy-isochroman-1-one
SpectraBase Compound ID Dmk2BAnx6lL
InChI InChI=1S/C15H21NO3/c1-9(2)7-11(16)13-8-10-5-4-6-12(18-3)14(10)15(17)19-13/h4-6,9,11,13H,7-8,16H2,1-3H3/t11-,13-/m0/s1
InChIKey NMHCHGNTXIFUMI-AAEUAGOBSA-N
Mol Weight 263.34 g/mol
Molecular Formula C15H21NO3
Exact Mass 263.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6RuWyIEHYt6
Name (3S)-3-[(1S)-1-amino-3-methyl-butyl]-8-methoxy-isochroman-1-one
Alternate Name(s) (3S)-3-[(1S)-1-amino-3-methylbutyl]-8-methoxy-3,4-dihydro-1H-2-benzopyran-1-one (3S)-3-[(1S)-1-amino-3-methylbutyl]-8-methoxy-3,4-dihydroisochromen-1-one (3S)-3-[(1S)-1-azanyl-3-methyl-butyl]-8-methoxy-3,4-dihydroisochromen-1-one
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Formula C15H21NO3
InChI InChI=1S/C15H21NO3/c1-9(2)7-11(16)13-8-10-5-4-6-12(18-3)14(10)15(17)19-13/h4-6,9,11,13H,7-8,16H2,1-3H3/t11-,13-/m0/s1
InChIKey NMHCHGNTXIFUMI-AAEUAGOBSA-N
Molecular Weight 263.337 g/mol
SMILES N[C@]([C@]1(OC(c2c(cccc2OC)C1)=O)[H])(CC(C)C)[H]
SPLASH splash10-024i-0690000000-d27927ef0b2bae84a209
Source of Spectrum J-61-3186-10
Wiley ID 1266997