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Pigment red 32

View entire compound with spectra: 1 NMR, and 4 FTIR

Pigment red 32
SpectraBase Compound ID LZkx8JVH2o0
InChI InChI=1S/C31H24N4O4/c1-39-27-17-16-21(30(37)32-22-11-4-2-5-12-22)19-26(27)34-35-28-24-15-9-8-10-20(24)18-25(29(28)36)31(38)33-23-13-6-3-7-14-23/h2-19,36H,1H3,(H,32,37)(H,33,38)/b35-34+
InChIKey JBJBSAHNMRBDSH-XAHDOWKMSA-N
Mol Weight 516.56 g/mol
Molecular Formula C31H24N4O4
Exact Mass 516.179755 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2IEnapRbl5w
Name Pigment red 32
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 516.179755265 u
Formula C31H24N4O4
InChI InChI=1S/C31H24N4O4/c1-39-27-17-16-21(30(37)32-22-11-4-2-5-12-22)19-26(27)34-35-28-24-15-9-8-10-20(24)18-25(29(28)36)31(38)33-23-13-6-3-7-14-23/h2-19,36H,1H3,(H,32,37)(H,33,38)/b35-34+
InChIKey JBJBSAHNMRBDSH-XAHDOWKMSA-N
Molecular Weight 516.557 g/mol
Nominal Mass 516 u
SMILES N(C=1C=CC=CC1)C(C1=CC(\N=N\C2=C(C(C(=O)NC3=CC=CC=C3)=CC3=C2C=CC=C3)O)=C(C=C1)OC)=O