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2-[4-(2-Hydroxy-3,5-dibromobenzylideneamino)phenyl]-6-

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

2-[4-(2-Hydroxy-3,5-dibromobenzylideneamino)phenyl]-6-
SpectraBase Compound ID K3dBqErWjU1
InChI InChI=1S/C21H14Br2N2OS/c1-12-2-7-18-19(8-12)27-21(25-18)13-3-5-16(6-4-13)24-11-14-9-15(22)10-17(23)20(14)26/h2-11,26H,1H3/b24-11+
InChIKey YLUYUICVQDLKCG-BHGWPJFGSA-N
Mol Weight 502.22 g/mol
Molecular Formula C21H14Br2N2OS
Exact Mass 499.91936 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G7p7RQoy8vK
Name 2-[4-(2-Hydroxy-3,5-dibromobenzylideneamino)phenyl]-6-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 499.919360252 u
Formula C21H14Br2N2OS
InChI InChI=1S/C21H14Br2N2OS/c1-12-2-7-18-19(8-12)27-21(25-18)13-3-5-16(6-4-13)24-11-14-9-15(22)10-17(23)20(14)26/h2-11,26H,1H3/b24-11+
InChIKey YLUYUICVQDLKCG-BHGWPJFGSA-N
Molecular Weight 502.224 g/mol
SMILES Oc1c(\C=N\c2ccc(C3=Nc4ccc(cc4S3)C)cc2)cc(cc1Br)Br