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

*Links on SpectraBase are not permalinks.
Benzeneacetic acid, .alpha.-hydroxy-3-methoxy-4-[(phenoxycarbonyl)amino]-.alpha.-(trifluoromethyl)-, methyl ester
SpectraBase Compound ID KrkkFSruC7S
InChI InChI=1S/C18H16F3NO6/c1-26-14-10-11(17(25,15(23)27-2)18(19,20)21)8-9-13(14)22-16(24)28-12-6-4-3-5-7-12/h3-10,25H,1-2H3,(H,22,24)
InChIKey JHDMKHOPCAUVLU-UHFFFAOYSA-N
Mol Weight 399.32 g/mol
Molecular Formula C18H16F3NO6
Exact Mass 399.092972 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 LOeLfdS0WPl
Name Benzeneacetic acid, .alpha.-hydroxy-3-methoxy-4-[(phenoxycarbonyl)amino]-.alpha.-(trifluoromethyl)-, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16F3NO6
InChI InChI=1S/C18H16F3NO6/c1-26-14-10-11(17(25,15(23)27-2)18(19,20)21)8-9-13(14)22-16(24)28-12-6-4-3-5-7-12/h3-10,25H,1-2H3,(H,22,24)
InChIKey JHDMKHOPCAUVLU-UHFFFAOYSA-N
Molecular Weight 399.322 g/mol
SMILES OC(c1cc(c(cc1)NC(=O)Oc1ccccc1)OC)(C(F)(F)F)C(OC)=O
SPLASH splash10-052b-1279000000-d35c44f3719cdd254ff7
Source of Spectrum IY-2-4879-7
Synonyms Methyl 3,3,3-trifluoro-2-hydroxy-2-{3-methoxy-4-[(phenoxycarbonyl)amino]phenyl}propanoate 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-[[oxo(phenoxy)methyl]amino]phenyl]propanoic acid methyl ester Methyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(phenoxycarbonylamino)phenyl]propanoate Methyl 3,3,3-tris(fluoranyl)-2-[3-methoxy-4-(phenoxycarbonylamino)phenyl]-2-oxidanyl-propanoate
Wiley ID 1656554