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ethyl 4-(4-methoxy-1,3-dimethyl-8-oxocyclohepta[c]pyrrol-2(8H)-yl)benzoate
SpectraBase Compound ID W5sm2LhJTJ
InChI InChI=1S/C21H21NO4/c1-5-26-21(24)15-9-11-16(12-10-15)22-13(2)19-17(23)7-6-8-18(25-4)20(19)14(22)3/h6-12H,5H2,1-4H3
InChIKey FBEIFQSHFXTRDI-UHFFFAOYSA-N
Mol Weight 351.4 g/mol
Molecular Formula C21H21NO4
Exact Mass 351.147058 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JD2uOp28WVc
Name ethyl 4-(4-methoxy-1,3-dimethyl-8-oxocyclohepta[c]pyrrol-2(8H)-yl)benzoate
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/C21H21NO4/c1-5-26-21(24)15-9-11-16(12-10-15)22-13(2)19-17(23)7-6-8-18(25-4)20(19)14(22)3/h6-12H,5H2,1-4H3
InChIKey FBEIFQSHFXTRDI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_10941
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: E03392; Labnumber: RRAR-695; SBI_ID: SBI-010944
Temperature 318 °C