For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,3,5-Tris((4-(2-(4-phenylthiazol-2-yl)hydrazono)methyl)phenoxy)methyl)benzene
SpectraBase Compound ID 6iKrDNqlS80
InChI InChI=1S/C57H45N9O3S3/c1-4-10-46(11-5-1)52-37-70-55(61-52)64-58-31-40-16-22-49(23-17-40)67-34-43-28-44(35-68-50-24-18-41(19-25-50)32-59-65-56-62-53(38-71-56)47-12-6-2-7-13-47)30-45(29-43)36-69-51-26-20-42(21-27-51)33-60-66-57-63-54(39-72-57)48-14-8-3-9-15-48/h1-33,37-39H,34-36H2,(H,61,64)(H,62,65)(H,63,66)
InChIKey FHLXWIZEQGHVBH-UHFFFAOYSA-N
Mol Weight 1000.2 g/mol
Molecular Formula C57H45N9O3S3
Exact Mass 999.28075 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID B1WlbJ6Wc2i
Name 1,3,5-Tris((4-(2-(4-phenylthiazol-2-yl)hydrazono)methyl)phenoxy)methyl)benzene
Appearance Orange powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C57H45N9O3S3
InChI InChI=1S/C57H45N9O3S3/c1-4-10-46(11-5-1)52-37-70-55(61-52)64-58-31-40-16-22-49(23-17-40)67-34-43-28-44(35-68-50-24-18-41(19-25-50)32-59-65-56-62-53(38-71-56)47-12-6-2-7-13-47)30-45(29-43)36-69-51-26-20-42(21-27-51)33-60-66-57-63-54(39-72-57)48-14-8-3-9-15-48/h1-33,37-39H,34-36H2,(H,61,64)(H,62,65)(H,63,66)
InChIKey FHLXWIZEQGHVBH-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS QP 1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2629
Molecular Weight 1000.227 g/mol
SMILES N(N=Cc1ccc(OCc2cc(COc3ccc(C=NNc4scc(n4)-c4ccccc4)cc3)cc(c2)COc2ccc(cc2)C=NNc2scc(n2)-c2ccccc2)cc1)c1scc(n1)-c1ccccc1
SPLASH splash10-00kf-1010100059-04f3832557fa9c4e8e85
Source of Spectrum Y-54-592-11a
Wiley ID 1877889