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4H-1-benzopyran-3-carbonitrile, 2-amino-4-(4-chloro-3-nitrophenyl)-5,6,7,8-tetrahydro-7,7-dimethyl-5-oxo-
SpectraBase Compound ID 5YetHzdLW81
InChI InChI=1S/C18H16ClN3O4/c1-18(2)6-13(23)16-14(7-18)26-17(21)10(8-20)15(16)9-3-4-11(19)12(5-9)22(24)25/h3-5,15H,6-7,21H2,1-2H3
InChIKey UYMOXCHMLNMVAS-UHFFFAOYSA-N
Mol Weight 373.8 g/mol
Molecular Formula C18H16ClN3O4
Exact Mass 373.082934 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1AYGRDjsaV3
Name 4H-1-benzopyran-3-carbonitrile, 2-amino-4-(4-chloro-3-nitrophenyl)-5,6,7,8-tetrahydro-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/C18H16ClN3O4/c1-18(2)6-13(23)16-14(7-18)26-17(21)10(8-20)15(16)9-3-4-11(19)12(5-9)22(24)25/h3-5,15H,6-7,21H2,1-2H3
InChIKey UYMOXCHMLNMVAS-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_1092
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: 63TSH0.221; IOH_ID: IOH-008094