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11-[4-(dimethylamino)phenyl]-3,3-dimethyl-10-(3-methylbutanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

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11-[4-(dimethylamino)phenyl]-3,3-dimethyl-10-(3-methylbutanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
SpectraBase Compound ID FEoOjTjpwQJ
InChI InChI=1S/C28H35N3O2/c1-18(2)15-25(33)31-23-10-8-7-9-21(23)29-22-16-28(3,4)17-24(32)26(22)27(31)19-11-13-20(14-12-19)30(5)6/h7-14,18,27,29H,15-17H2,1-6H3
InChIKey KBIPPHDYJJXYAY-UHFFFAOYSA-N
Mol Weight 445.6 g/mol
Molecular Formula C28H35N3O2
Exact Mass 445.272927 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IBql6izkWZJ
Name 11-[4-(dimethylamino)phenyl]-3,3-dimethyl-10-(3-methylbutanoyl)-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/C28H35N3O2/c1-18(2)15-25(33)31-23-10-8-7-9-21(23)29-22-16-28(3,4)17-24(32)26(22)27(31)19-11-13-20(14-12-19)30(5)6/h7-14,18,27,29H,15-17H2,1-6H3
InChIKey KBIPPHDYJJXYAY-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16719
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/8173546; UBI_ID: UBI-016722
Temperature 303 °C