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benzenemethanol, 2-hydroxy-4-methyl-alpha-[[2,3,6,7-tetrahydro-7-(4-methoxyphenyl)-1H-1,4-diazepin-5-yl]methylene]-
SpectraBase Compound ID 8FyODuw7LDd
InChI InChI=1S/C21H24N2O3/c1-14-3-8-18(20(24)11-14)21(25)13-16-12-19(23-10-9-22-16)15-4-6-17(26-2)7-5-15/h3-8,11,13,19,23-25H,9-10,12H2,1-2H3/b21-13-
InChIKey QKTRTHFKUWNSKY-BKUYFWCQSA-N
Mol Weight 352.43 g/mol
Molecular Formula C21H24N2O3
Exact Mass 352.178693 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FFO0GaaKB0g
Name benzenemethanol, 2-hydroxy-4-methyl-alpha-[[2,3,6,7-tetrahydro-7-(4-methoxyphenyl)-1H-1,4-diazepin-5-yl]methylene]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 352.178692638 u
Formula C21H24N2O3
InChI InChI=1S/C21H24N2O3/c1-14-3-8-18(20(24)11-14)21(25)13-16-12-19(23-10-9-22-16)15-4-6-17(26-2)7-5-15/h3-8,11,13,19,23-25H,9-10,12H2,1-2H3/b21-13-
InChIKey QKTRTHFKUWNSKY-BKUYFWCQSA-N
Molecular Weight 352.434 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13769
Solvent DMSO-d6
Source Vendor ID: NMR/10270667; Lab Info: GOR; Lab Number: GOR-EC00002