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4H-1-benzopyran-3-carbonitrile, 2-amino-5,6,7,8-tetrahydro-4-[4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl]-7,7-dimethyl-5-oxo-

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4H-1-benzopyran-3-carbonitrile, 2-amino-5,6,7,8-tetrahydro-4-[4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl]-7,7-dimethyl-5-oxo-
SpectraBase Compound ID 3IOnjLy3jUa
InChI InChI=1S/C27H27N3O6/c1-15-9-18(6-7-20(15)30(32)33)35-14-17-10-16(5-8-22(17)34-4)24-19(13-28)26(29)36-23-12-27(2,3)11-21(31)25(23)24/h5-10,24H,11-12,14,29H2,1-4H3
InChIKey NUQORQIJVNCVLA-UHFFFAOYSA-N
Mol Weight 489.53 g/mol
Molecular Formula C27H27N3O6
Exact Mass 489.189986 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3c3DKa2S6f3
Name 4H-1-benzopyran-3-carbonitrile, 2-amino-5,6,7,8-tetrahydro-4-[4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl]-7,7-dimethyl-5-oxo-
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/C27H27N3O6/c1-15-9-18(6-7-20(15)30(32)33)35-14-17-10-16(5-8-22(17)34-4)24-19(13-28)26(29)36-23-12-27(2,3)11-21(31)25(23)24/h5-10,24H,11-12,14,29H2,1-4H3
InChIKey NUQORQIJVNCVLA-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_2844
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: NMR/10218507