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Glutaric acid, 1,1,1-trifluoroprop-2-yl 3-nitrophenyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 1,1,1-trifluoroprop-2-yl 3-nitrophenyl ester
SpectraBase Compound ID 3GhlGDSXY2M
InChI InChI=1S/C14H14F3NO6/c1-9(14(15,16)17)23-12(19)6-3-7-13(20)24-11-5-2-4-10(8-11)18(21)22/h2,4-5,8-9H,3,6-7H2,1H3
InChIKey CLXLVIVRGYSONN-UHFFFAOYSA-N
Mol Weight 349.26 g/mol
Molecular Formula C14H14F3NO6
Exact Mass 349.077322 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AjygyQTl52w
Name Glutaric acid, 1,1,1-trifluoroprop-2-yl 3-nitrophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 349.077321658 u
Formula C14H14F3NO6
InChI InChI=1S/C14H14F3NO6/c1-9(14(15,16)17)23-12(19)6-3-7-13(20)24-11-5-2-4-10(8-11)18(21)22/h2,4-5,8-9H,3,6-7H2,1H3
InChIKey CLXLVIVRGYSONN-UHFFFAOYSA-N
Molecular Weight 349.262 g/mol
SMILES C(CCC(OC(C)C(F)(F)F)=O)C(OC1=CC=CC(=C1)N(=O)=O)=O