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Pigment red 148

View entire compound with spectra: 1 NMR, 2 FTIR, and 1 MS (GC)

Pigment red 148
SpectraBase Compound ID JwgsiBEouLh
InChI InChI=1S/C24H17Cl2N3O2/c1-14-6-2-5-9-20(14)27-24(31)18-12-15-7-3-4-8-17(15)22(23(18)30)29-28-21-11-10-16(25)13-19(21)26/h2-13,30H,1H3,(H,27,31)/b29-28+
InChIKey SLPRWGABVRKMBE-ZQHSETAFSA-N
Mol Weight 450.33 g/mol
Molecular Formula C24H17Cl2N3O2
Exact Mass 449.069782 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4oiQdhrisAn
Name Pigment red 148
Comments Computed using HOSE algorithm
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Exact Mass 449.069782197 u
Formula C24H17Cl2N3O2
InChI InChI=1S/C24H17Cl2N3O2/c1-14-6-2-5-9-20(14)27-24(31)18-12-15-7-3-4-8-17(15)22(23(18)30)29-28-21-11-10-16(25)13-19(21)26/h2-13,30H,1H3,(H,27,31)/b29-28+
InChIKey SLPRWGABVRKMBE-ZQHSETAFSA-N
Molecular Weight 450.325 g/mol
SMILES N(C(C1=CC2=C(C(=C1O)\N=N\C1=C(C=C(C=C1)Cl)Cl)C=CC=C2)=O)C1=C(C=CC=C1)C