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(2E,6E)-4-methyl-2,6-bis[4-(pentyloxy)benzylidene]cyclohexanone
SpectraBase Compound ID Icp3kUpn0Rg
InChI InChI=1S/C31H40O3/c1-4-6-8-18-33-29-14-10-25(11-15-29)22-27-20-24(3)21-28(31(27)32)23-26-12-16-30(17-13-26)34-19-9-7-5-2/h10-17,22-24H,4-9,18-21H2,1-3H3/b27-22+,28-23+
InChIKey ZPBKGYUJFBXAKP-OGNOVMCBSA-N
Mol Weight 460.7 g/mol
Molecular Formula C31H40O3
Exact Mass 460.297745 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Cd5hhnA60QI
Name (2E,6E)-4-methyl-2,6-bis[4-(pentyloxy)benzylidene]cyclohexanone
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 460.297745145 u
Formula C31H40O3
InChI InChI=1S/C31H40O3/c1-4-6-8-18-33-29-14-10-25(11-15-29)22-27-20-24(3)21-28(31(27)32)23-26-12-16-30(17-13-26)34-19-9-7-5-2/h10-17,22-24H,4-9,18-21H2,1-3H3/b27-22+,28-23+
InChIKey ZPBKGYUJFBXAKP-OGNOVMCBSA-N
Molecular Weight 460.658 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7892
Solvent DMSO-d6
Source Vendor ID: NMR/13218709