SpectraBase Compound ID | 7JTxBXTFUa4 |
---|---|
InChI | InChI=1S/C14H8F3NO5/c15-14(16,17)8-5-6-12(10(7-8)18(21)22)23-11-4-2-1-3-9(11)13(19)20/h1-7H,(H,19,20) |
InChIKey | QYMYSTUGDQHGKX-UHFFFAOYSA-N |
Mol Weight | 327.22 g/mol |
Molecular Formula | C14H8F3NO5 |
Exact Mass | 327.035457 g/mol |
SpectraBase Spectrum ID | Ih7Vrh7BRVF |
---|---|
Name | 2-(2-Nitro-4-trifluoromethyl-phenoxy)-benzoic acid |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C14H8F3NO5 |
InChI | InChI=1S/C14H8F3NO5/c15-14(16,17)8-5-6-12(10(7-8)18(21)22)23-11-4-2-1-3-9(11)13(19)20/h1-7H,(H,19,20) |
InChIKey | QYMYSTUGDQHGKX-UHFFFAOYSA-N |
Molecular Weight | 327.215 g/mol |
SMILES | OC(c1c(Oc2c(N(=O)=O)cc(C(F)(F)F)cc2)cccc1)=O |
SPLASH | splash10-00dl-8920000000-71c04457ced592e5c36e |
Wiley ID | 1441793 |