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ethyl 5-fluoro-3-({[(1S,9S)-6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl]acetyl}amino)-1H-indole-2-carboxylate

View entire compound with spectra: 1 NMR

ethyl 5-fluoro-3-({[(1S,9S)-6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl]acetyl}amino)-1H-indole-2-carboxylate
SpectraBase Compound ID LcWuHnbBvTo
InChI InChI=1S/C24H25FN4O4/c1-2-33-24(32)23-22(17-9-16(25)6-7-18(17)26-23)27-20(30)13-28-10-14-8-15(12-28)19-4-3-5-21(31)29(19)11-14/h3-7,9,14-15,26H,2,8,10-13H2,1H3,(H,27,30)
InChIKey SMJUTDPWVSPTSJ-UHFFFAOYSA-N
Mol Weight 452.49 g/mol
Molecular Formula C24H25FN4O4
Exact Mass 452.185983 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HsoOQ3vs7xB
Name ethyl 5-fluoro-3-({[(1S,9S)-6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl]acetyl}amino)-1H-indole-2-carboxylate
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/C24H25FN4O4/c1-2-33-24(32)23-22(17-9-16(25)6-7-18(17)26-23)27-20(30)13-28-10-14-8-15(12-28)19-4-3-5-21(31)29(19)11-14/h3-7,9,14-15,26H,2,8,10-13H2,1H3,(H,27,30)
InChIKey SMJUTDPWVSPTSJ-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_13450
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: 102047; Labnumber: PRBS2-20292; VK_ID: VK-013455
Synonyms ethyl 5-fluoro-3-({[6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl]acetyl}amino)-1H-indole-2-carboxylate
Temperature 308 °C