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(2E,5E)-2,5-bis[4-(isopentyloxy)-3-methoxybenzylidene]cyclopentanone
SpectraBase Compound ID BiAKMQApKha
InChI InChI=1S/C31H40O5/c1-21(2)13-15-35-27-11-7-23(19-29(27)33-5)17-25-9-10-26(31(25)32)18-24-8-12-28(30(20-24)34-6)36-16-14-22(3)4/h7-8,11-12,17-22H,9-10,13-16H2,1-6H3/b25-17+,26-18+
InChIKey AOBNWGJYYQSQJE-RPCRKUJJSA-N
Mol Weight 492.7 g/mol
Molecular Formula C31H40O5
Exact Mass 492.287574 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DJt217Q6Yt6
Name cyclopentanone, 2,5-bis[[3-methoxy-4-(3-methylbutoxy)phenyl]methylene]-, (2E,5E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 492.287574383 u
Formula C31H40O5
InChI InChI=1S/C31H40O5/c1-21(2)13-15-35-27-11-7-23(19-29(27)33-5)17-25-9-10-26(31(25)32)18-24-8-12-28(30(20-24)34-6)36-16-14-22(3)4/h7-8,11-12,17-22H,9-10,13-16H2,1-6H3/b25-17+,26-18+
InChIKey AOBNWGJYYQSQJE-RPCRKUJJSA-N
Molecular Weight 492.656 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6586
Solvent DMSO-d6
Source Vendor ID: NMR/13289989