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4-(Hexyloxy)phenyl 2-(4-chlorobenzoyl)benzoate

View entire compound with spectra: 2 NMR

4-(Hexyloxy)phenyl 2-(4-chlorobenzoyl)benzoate
SpectraBase Compound ID JktwzDHLrGG
InChI InChI=1S/C26H25ClO4/c1-2-3-4-7-18-30-21-14-16-22(17-15-21)31-26(29)24-9-6-5-8-23(24)25(28)19-10-12-20(27)13-11-19/h5-6,8-17H,2-4,7,18H2,1H3
InChIKey HECBLVHOSXPEBR-UHFFFAOYSA-N
Mol Weight 436.94 g/mol
Molecular Formula C26H25ClO4
Exact Mass 436.144137 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID WSpuGpbaBC
Name 4-(Hexyloxy)phenyl 2-(4-chlorobenzoyl)benzoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 436.144136981 u
Formula C26H25ClO4
InChI InChI=1S/C26H25ClO4/c1-2-3-4-7-18-30-21-14-16-22(17-15-21)31-26(29)24-9-6-5-8-23(24)25(28)19-10-12-20(27)13-11-19/h5-6,8-17H,2-4,7,18H2,1H3
InChIKey HECBLVHOSXPEBR-UHFFFAOYSA-N
Molecular Weight 436.935 g/mol
SMILES C(C=1C(C(C=2C=CC(=CC2)Cl)=O)=CC=CC1)(OC1=CC=C(C=C1)OCCCCCC)=O