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2H-1-benzopyran-2-one, 6-chloro-3-[2-[4-(4-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]-4-methyl-7-[(2-methyl-2-propenyl)oxy]-

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2H-1-benzopyran-2-one, 6-chloro-3-[2-[4-(4-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]-4-methyl-7-[(2-methyl-2-propenyl)oxy]-
SpectraBase Compound ID KycRKP2wSRX
InChI InChI=1S/C27H29ClN2O5/c1-17(2)16-34-25-15-24-21(13-23(25)28)18(3)22(27(32)35-24)14-26(31)30-11-9-29(10-12-30)19-5-7-20(33-4)8-6-19/h5-8,13,15H,1,9-12,14,16H2,2-4H3
InChIKey KGWWUGNEYYMZCQ-UHFFFAOYSA-N
Mol Weight 496.99 g/mol
Molecular Formula C27H29ClN2O5
Exact Mass 496.1765 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IQcggMq2ite
Name 2H-1-benzopyran-2-one, 6-chloro-3-[2-[4-(4-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]-4-methyl-7-[(2-methyl-2-propenyl)oxy]-
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/C27H29ClN2O5/c1-17(2)16-34-25-15-24-21(13-23(25)28)18(3)22(27(32)35-24)14-26(31)30-11-9-29(10-12-30)19-5-7-20(33-4)8-6-19/h5-8,13,15H,1,9-12,14,16H2,2-4H3
InChIKey KGWWUGNEYYMZCQ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_107
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: F02913; Labnumber: ExLab-143354