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Succinic acid, heptyl 2-(trifluoromethyl)benzyl ester

View entire compound with spectra: 1 NMR

Succinic acid, heptyl 2-(trifluoromethyl)benzyl ester
SpectraBase Compound ID L0AtTlLHFgW
InChI InChI=1S/C19H25F3O4/c1-2-3-4-5-8-13-25-17(23)11-12-18(24)26-14-15-9-6-7-10-16(15)19(20,21)22/h6-7,9-10H,2-5,8,11-14H2,1H3
InChIKey WFDQWKZYHYRTSP-UHFFFAOYSA-N
Mol Weight 374.4 g/mol
Molecular Formula C19H25F3O4
Exact Mass 374.170494 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KP88dXgtZJP
Name Succinic acid, heptyl 2-(trifluoromethyl)benzyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 374.170493770 u
Formula C19H25F3O4
InChI InChI=1S/C19H25F3O4/c1-2-3-4-5-8-13-25-17(23)11-12-18(24)26-14-15-9-6-7-10-16(15)19(20,21)22/h6-7,9-10H,2-5,8,11-14H2,1H3
InChIKey WFDQWKZYHYRTSP-UHFFFAOYSA-N
Molecular Weight 374.400 g/mol
SMILES C(CCC(OCC1=CC=CC=C1C(F)(F)F)=O)(OCCCCCCC)=O