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3-Chloroazulene-1-azo[4'-(diphenylhydroxymethyl)bezene]
SpectraBase Compound ID ctuGNwfsCh
InChI InChI=1S/C29H21ClN2O/c30-27-20-28(26-15-9-3-8-14-25(26)27)32-31-24-18-16-23(17-19-24)29(33,21-10-4-1-5-11-21)22-12-6-2-7-13-22/h1-20,33H/b32-31+
InChIKey ZHJXFRRTKVPQAA-QNEJGDQOSA-N
Mol Weight 448.95 g/mol
Molecular Formula C29H21ClN2O
Exact Mass 448.134241 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DKcT1iZO2W0
Name 3-Chloroazulene-1-azo[4'-(diphenylhydroxymethyl)bezene]
Comments Less than 3 mono-isotopic peaks
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Formula C29H21ClN2O
InChI InChI=1S/C29H21ClN2O/c30-27-20-28(26-15-9-3-8-14-25(26)27)32-31-24-18-16-23(17-19-24)29(33,21-10-4-1-5-11-21)22-12-6-2-7-13-22/h1-20,33H/b32-31+
InChIKey ZHJXFRRTKVPQAA-QNEJGDQOSA-N
Molecular Weight 448.953 g/mol
SMILES OC(c1ccc(\N=N\c2c3c(ccccc3)c(c2)Cl)cc1)(c1ccccc1)c1ccccc1
SPLASH splash10-01ot-0600900000-0d6ab3c7b45ebca94868
Source of Spectrum KC-0-993-9
Wiley ID 830320