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(2E)-2-[4-(pentyloxy)benzylidene]-2,3-dihydro-1H-inden-1-one
SpectraBase Compound ID DKWesr0Kkbl
InChI InChI=1S/C21H22O2/c1-2-3-6-13-23-19-11-9-16(10-12-19)14-18-15-17-7-4-5-8-20(17)21(18)22/h4-5,7-12,14H,2-3,6,13,15H2,1H3/b18-14+
InChIKey XZSCEOWFUWSPMC-NBVRZTHBSA-N
Mol Weight 306.41 g/mol
Molecular Formula C21H22O2
Exact Mass 306.16198 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9naV8acPM4r
Name (2E)-2-[4-(pentyloxy)benzylidene]-2,3-dihydro-1H-inden-1-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 306.161979946 u
Formula C21H22O2
InChI InChI=1S/C21H22O2/c1-2-3-6-13-23-19-11-9-16(10-12-19)14-18-15-17-7-4-5-8-20(17)21(18)22/h4-5,7-12,14H,2-3,6,13,15H2,1H3/b18-14+
InChIKey XZSCEOWFUWSPMC-NBVRZTHBSA-N
Molecular Weight 306.405 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5865
Solvent DMSO-d6
Source Vendor ID: NMR/12319381