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

*Links on SpectraBase are not permalinks.
2-[2-(Benzoylimino)-4-(4-bromophenyl)thiazol-3(2H)-yl]-3-methylbutanoic acid
SpectraBase Compound ID H31YHD6nhAv
InChI InChI=1S/C21H19BrN2O3S/c1-13(2)18(20(26)27)24-17(14-8-10-16(22)11-9-14)12-28-21(24)23-19(25)15-6-4-3-5-7-15/h3-13,18H,1-2H3,(H,26,27)/b23-21-
InChIKey MZBOEJVPHIGUIJ-LNVKXUELSA-N
Mol Weight 459.36 g/mol
Molecular Formula C21H19BrN2O3S
Exact Mass 458.029977 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 KH2IkByRNCc
Name 2-[2-(Benzoylimino)-4-(4-bromophenyl)thiazol-3(2H)-yl]-3-methylbutanoic acid
Alternate Name(s) (Z)-2-(2-(benzoylimino)-4-(4-bromophenyl)thiazol-3(2H)-yl)-3-methylbutanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19BrN2O3S
InChI InChI=1S/C21H19BrN2O3S/c1-13(2)18(20(26)27)24-17(14-8-10-16(22)11-9-14)12-28-21(24)23-19(25)15-6-4-3-5-7-15/h3-13,18H,1-2H3,(H,26,27)/b23-21-
InChIKey MZBOEJVPHIGUIJ-LNVKXUELSA-N
Literature Reference DOI 10.1016/j.cclet.2013.11.009
Molecular Weight 459.358 g/mol
SMILES OC(C(C(C)C)N1C(=CS\C1=N\C(c1ccccc1)=O)c1ccc(cc1)Br)=O
SPLASH splash10-0a4i-2906000000-0acea66802f6ba3f289a
Source of Spectrum CCL-25-121-4i
Wiley ID 1743751