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11-(3-chloro-5-ethoxy-4-hydroxyphenyl)-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
SpectraBase Compound ID 40RynvZbXSm
InChI InChI=1S/C28H27ClN2O4/c1-3-35-25-15-18(12-20(29)28(25)33)27-26-23(30-21-6-4-5-7-22(21)31-27)13-17(14-24(26)32)16-8-10-19(34-2)11-9-16/h4-12,15,17,27,30-31,33H,3,13-14H2,1-2H3
InChIKey MMMVLXUCHWWCIQ-UHFFFAOYSA-N
Mol Weight 490.99 g/mol
Molecular Formula C28H27ClN2O4
Exact Mass 490.165935 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KshnFni9jzm
Name 11-(3-chloro-5-ethoxy-4-hydroxyphenyl)-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
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/C28H27ClN2O4/c1-3-35-25-15-18(12-20(29)28(25)33)27-26-23(30-21-6-4-5-7-22(21)31-27)13-17(14-24(26)32)16-8-10-19(34-2)11-9-16/h4-12,15,17,27,30-31,33H,3,13-14H2,1-2H3
InChIKey MMMVLXUCHWWCIQ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_18159
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: UZI/9120169; UBI_ID: UBI-018162
Temperature 318 °C