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1-(o-Aminophenyl)-3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolineacetic acid, salicylidenehydrazide
SpectraBase Compound ID C4i1r3yfGAr
InChI InChI=1S/C26H28N4O4/c1-33-23-13-17-11-12-30(16-25(32)29-28-15-18-7-3-6-10-22(18)31)26(20(17)14-24(23)34-2)19-8-4-5-9-21(19)27/h3-10,13-15,26,31H,11-12,16,27H2,1-2H3,(H,29,32)/b28-15+
InChIKey VREPSYCDDHMCON-RWPZCVJISA-N
Mol Weight 460.53 g/mol
Molecular Formula C26H28N4O4
Exact Mass 460.211055 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6MuoRnJZhzF
Name 1-(o-Aminophenyl)-3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolineacetic acid, salicylidenehydrazide
Comments Computed using HOSE algorithm
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Exact Mass 460.211055394 u
Formula C26H28N4O4
InChI InChI=1S/C26H28N4O4/c1-33-23-13-17-11-12-30(16-25(32)29-28-15-18-7-3-6-10-22(18)31)26(20(17)14-24(23)34-2)19-8-4-5-9-21(19)27/h3-10,13-15,26,31H,11-12,16,27H2,1-2H3,(H,29,32)/b28-15+
InChIKey VREPSYCDDHMCON-RWPZCVJISA-N
Molecular Weight 460.534 g/mol
SMILES OC=1C=CC=CC1\C=N\NC(CN1CCC2=C(C1C1=C(C=CC=C1)N)C=C(C(=C2)OC)OC)=O