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

*Links on SpectraBase are not permalinks.
5-Bromo-2-{[(2,4-dichlorophenoxy)acetyl]amino}benzoic acid, tms derivative
SpectraBase Compound ID FCtXRx6KJ5g
InChI InChI=1S/C18H18BrCl2NO4Si/c1-27(2,3)26-18(24)13-8-11(19)4-6-15(13)22-17(23)10-25-16-7-5-12(20)9-14(16)21/h4-9H,10H2,1-3H3,(H,22,23)
InChIKey JLBMNAGRIALVDM-UHFFFAOYSA-N
Mol Weight 491.24 g/mol
Molecular Formula C18H18BrCl2NO4Si
Exact Mass 488.956553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID Hy3BRil7oKt
Name 5-Bromo-2-{[(2,4-dichlorophenoxy)acetyl]amino}benzoic acid, tms derivative
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 488.956552995 u
Formula C18H18BrCl2NO4Si
InChI InChI=1S/C18H18BrCl2NO4Si/c1-27(2,3)26-18(24)13-8-11(19)4-6-15(13)22-17(23)10-25-16-7-5-12(20)9-14(16)21/h4-9H,10H2,1-3H3,(H,22,23)
InChIKey JLBMNAGRIALVDM-UHFFFAOYSA-N
Molecular Weight 491.240 g/mol
SMILES C1(Br)=CC(=C(C=C1)NC(=O)COC1=C(C=C(C=C1)Cl)Cl)C(=O)O[Si](C)(C)C