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1-(4-chlorophenyl)-4-(4-methoxyphenyl)-N-(3-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide

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1-(4-chlorophenyl)-4-(4-methoxyphenyl)-N-(3-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
SpectraBase Compound ID 3Lnte5xXzaI
InChI InChI=1S/C31H28ClN3O2/c1-20-6-5-7-24(18-20)33-30(36)29-28(22-9-13-23(32)14-10-22)26-8-3-4-17-34-27(19-35(29)31(26)34)21-11-15-25(37-2)16-12-21/h5-7,9-16,18-19H,3-4,8,17H2,1-2H3,(H,33,36)
InChIKey UPLICPGJMVDPBZ-UHFFFAOYSA-N
Mol Weight 510.04 g/mol
Molecular Formula C31H28ClN3O2
Exact Mass 509.187005 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CONLUOkIv9h
Name 1-(4-chlorophenyl)-4-(4-methoxyphenyl)-N-(3-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C31H28ClN3O2/c1-20-6-5-7-24(18-20)33-30(36)29-28(22-9-13-23(32)14-10-22)26-8-3-4-17-34-27(19-35(29)31(26)34)21-11-15-25(37-2)16-12-21/h5-7,9-16,18-19H,3-4,8,17H2,1-2H3,(H,33,36)
InChIKey UPLICPGJMVDPBZ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28501
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: D87943; Labnumber: SC_0314-1235; SBI_ID: SBI-028505
Temperature 318 °C