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1-piperazineacetamide, 4-[2-[[[4-(2-furanyl)-2,6-dioxocyclohexylidene]methyl]amino]ethyl]-N-[4-(6-methyl-2-
SpectraBase Compound ID 8YJO2Mfruoz
InChI InChI=1S/C33H35N5O4S/c1-22-4-9-27-31(17-22)43-33(36-27)23-5-7-25(8-6-23)35-32(41)21-38-14-12-37(13-15-38)11-10-34-20-26-28(39)18-24(19-29(26)40)30-3-2-16-42-30/h2-9,16-17,20,24,34H,10-15,18-19,21H2,1H3,(H,35,41)/b26-20-
InChIKey CVHODSKBHHQDPC-QOMWVZHYSA-N
Mol Weight 597.7 g/mol
Molecular Formula C33H35N5O4S
Exact Mass 597.240976 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6rsUP0UFWff
Name 1-piperazineacetamide, 4-[2-[[[4-(2-furanyl)-2,6-dioxocyclohexylidene]methyl]amino]ethyl]-N-[4-(6-methyl-2-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 597.240975797 u
Formula C33H35N5O4S
InChI InChI=1S/C33H35N5O4S/c1-22-4-9-27-31(17-22)43-33(36-27)23-5-7-25(8-6-23)35-32(41)21-38-14-12-37(13-15-38)11-10-34-20-26-28(39)18-24(19-29(26)40)30-3-2-16-42-30/h2-9,16-17,20,24,34H,10-15,18-19,21H2,1H3,(H,35,41)/b26-20-
InChIKey CVHODSKBHHQDPC-QOMWVZHYSA-N
Molecular Weight 597.734 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16419
Solvent DMSO-d6
Source Vendor ID: NMR/11241961; Lab Info: PRE; Lab Number: PRE-3803002