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2-amino-4-{5-[(2-bromophenoxy)methyl]-2,4-dimethylphenyl}-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile
SpectraBase Compound ID 1SzOp1xcCyF
InChI InChI=1S/C28H25BrN4O/c1-17-11-18(2)22(12-19(17)14-34-25-10-6-5-9-24(25)29)26-21-8-4-3-7-20(21)23(13-30)27(33)28(26,15-31)16-32/h5-7,9-12,21,26H,3-4,8,14,33H2,1-2H3
InChIKey DLBDLBHVWLPIGV-UHFFFAOYSA-N
Mol Weight 513.44 g/mol
Molecular Formula C28H25BrN4O
Exact Mass 512.121174 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7OhAxB3T7Vq
Name 2-amino-4-{5-[(2-bromophenoxy)methyl]-2,4-dimethylphenyl}-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile
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/C28H25BrN4O/c1-17-11-18(2)22(12-19(17)14-34-25-10-6-5-9-24(25)29)26-21-8-4-3-7-20(21)23(13-30)27(33)28(26,15-31)16-32/h5-7,9-12,21,26H,3-4,8,14,33H2,1-2H3
InChIKey DLBDLBHVWLPIGV-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_14257
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/1011404; UBI_ID: UBI-014260
Temperature 308 °C