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4,5-Dichloro-N-[(1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]phthalimide
SpectraBase Compound ID JyHxzBO1Gq
InChI InChI=1S/C18H14Cl2N2O2/c19-15-7-13-14(8-16(15)20)18(24)22(17(13)23)10-21-6-5-11-3-1-2-4-12(11)9-21/h1-4,7-8H,5-6,9-10H2
InChIKey MKYXFDGHTKUJQQ-UHFFFAOYSA-N
Mol Weight 361.23 g/mol
Molecular Formula C18H14Cl2N2O2
Exact Mass 360.043233 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FlyiOXRcAbu
Name 4,5-Dichloro-N-[(1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]phthalimide
Comments Computed using HOSE algorithm
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Exact Mass 360.043233097 u
Formula C18H14Cl2N2O2
InChI InChI=1S/C18H14Cl2N2O2/c19-15-7-13-14(8-16(15)20)18(24)22(17(13)23)10-21-6-5-11-3-1-2-4-12(11)9-21/h1-4,7-8H,5-6,9-10H2
InChIKey MKYXFDGHTKUJQQ-UHFFFAOYSA-N
Molecular Weight 361.228 g/mol
SMILES C12=C(C=CC=C2)CCN(C1)CN1C(=O)C2=C(C1=O)C=C(C(=C2)Cl)Cl