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Dimethyl 4-(6-bromo-1,3-benzodioxol-5-yl)-1-methyl-1,4-dihydro-3,5-pyridinedicarboxylate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Dimethyl 4-(6-bromo-1,3-benzodioxol-5-yl)-1-methyl-1,4-dihydro-3,5-pyridinedicarboxylate
SpectraBase Compound ID BH8t6WUGMJY
InChI InChI=1S/C17H16BrNO6/c1-19-6-10(16(20)22-2)15(11(7-19)17(21)23-3)9-4-13-14(5-12(9)18)25-8-24-13/h4-7,15H,8H2,1-3H3
InChIKey KUGCJWUQIRYEQK-UHFFFAOYSA-N
Mol Weight 410.22 g/mol
Molecular Formula C17H16BrNO6
Exact Mass 409.0161 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 71gWX4UcvXV
Name 3,5-pyridinedicarboxylic acid, 4-(6-bromo-1,3-benzodioxol-5-yl)-1,4-dihydro-1-methyl-, dimethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 409.016100233 u
Formula C17H16BrNO6
InChI InChI=1S/C17H16BrNO6/c1-19-6-10(16(20)22-2)15(11(7-19)17(21)23-3)9-4-13-14(5-12(9)18)25-8-24-13/h4-7,15H,8H2,1-3H3
InChIKey KUGCJWUQIRYEQK-UHFFFAOYSA-N
Molecular Weight 410.220 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11669
Solvent DMSO-d6
Source Vendor ID: NMR/10271293; Lab Info: SAS; Lab Number: SAS-tst4047
Temperature 29.85 °C