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2,2'-Azino-1,1'-Bis(p-chlorophenyl)bis(azathiolo[4,5-a]cycloheptatriene)
SpectraBase Compound ID AN4LlOg7q5H
InChI InChI=1S/C28H20Cl2N4S2/c29-19-11-15-21(16-12-19)33-23-7-3-1-5-9-25(23)35-27(33)31-32-28-34(22-17-13-20(30)14-18-22)24-8-4-2-6-10-26(24)36-28/h3-18H,1-2H2/b31-27-,32-28+
InChIKey AFMFOAREQRZCMZ-GYNJYFOTSA-N
Mol Weight 547.52 g/mol
Molecular Formula C28H20Cl2N4S2
Exact Mass 546.050644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID o94AfiRXc
Name 2,2'-Azino-1,1'-Bis(p-chlorophenyl)bis(azathiolo[4,5-a]cycloheptatriene)
Alternate Name(s) 2,2'-Azino-3,3'-Bis(p-chlorophenyl)bis(azathiolo[4,5-a]cycloheptatriene)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H20Cl2N4S2
InChI InChI=1S/C28H20Cl2N4S2/c29-19-11-15-21(16-12-19)33-23-7-3-1-5-9-25(23)35-27(33)31-32-28-34(22-17-13-20(30)14-18-22)24-8-4-2-6-10-26(24)36-28/h3-18H,1-2H2/b31-27-,32-28+
InChIKey AFMFOAREQRZCMZ-GYNJYFOTSA-N
Molecular Weight 547.522 g/mol
SMILES C=12N(\C(SC1C=CCC=C2)=N\N=C/1N(C=2C=CCC=CC2S1)c1ccc(cc1)Cl)c1ccc(cc1)Cl
SPLASH splash10-006t-0052090000-03edad2128df63cc74c1
Source of Spectrum H1-41-2310-6
Wiley ID 757418