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pyrimidine, 2-(1,3-benzodioxol-5-yl)hexahydro-1,3-bis[(4-methoxyphenyl)methyl]-
SpectraBase Compound ID KhtHeBL1oOB
InChI InChI=1S/C27H30N2O4/c1-30-23-9-4-20(5-10-23)17-28-14-3-15-29(18-21-6-11-24(31-2)12-7-21)27(28)22-8-13-25-26(16-22)33-19-32-25/h4-13,16,27H,3,14-15,17-19H2,1-2H3
InChIKey GVICTBANZBJREB-UHFFFAOYSA-N
Mol Weight 446.55 g/mol
Molecular Formula C27H30N2O4
Exact Mass 446.220557 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GdiK3k2RJep
Name pyrimidine, 2-(1,3-benzodioxol-5-yl)hexahydro-1,3-bis[(4-methoxyphenyl)methyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 446.220557450 u
Formula C27H30N2O4
InChI InChI=1S/C27H30N2O4/c1-30-23-9-4-20(5-10-23)17-28-14-3-15-29(18-21-6-11-24(31-2)12-7-21)27(28)22-8-13-25-26(16-22)33-19-32-25/h4-13,16,27H,3,14-15,17-19H2,1-2H3
InChIKey GVICTBANZBJREB-UHFFFAOYSA-N
Molecular Weight 446.547 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9681
Solvent DMSO-d6
Source Vendor ID: NMR/10240882; Lab Info: LP; Lab Number: LP-2100494
Temperature 23.85 °C