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2H-1-benzopyran-2-one, 6-chloro-7-[[4-(1,1-dimethylethyl)phenyl]methoxy]-3-hexyl-4-methyl-
SpectraBase Compound ID DxNPnjsc2bp
InChI InChI=1S/C27H33ClO3/c1-6-7-8-9-10-21-18(2)22-15-23(28)25(16-24(22)31-26(21)29)30-17-19-11-13-20(14-12-19)27(3,4)5/h11-16H,6-10,17H2,1-5H3
InChIKey WQLTXQFENUHOBO-UHFFFAOYSA-N
Mol Weight 441.0 g/mol
Molecular Formula C27H33ClO3
Exact Mass 440.211823 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E3rNREjL2BC
Name 2H-1-benzopyran-2-one, 6-chloro-7-[[4-(1,1-dimethylethyl)phenyl]methoxy]-3-hexyl-4-methyl-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C27H33ClO3/c1-6-7-8-9-10-21-18(2)22-15-23(28)25(16-24(22)31-26(21)29)30-17-19-11-13-20(14-12-19)27(3,4)5/h11-16H,6-10,17H2,1-5H3
InChIKey WQLTXQFENUHOBO-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_75
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/11219649