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5-butyl-2-(1H-indol-3-yl)-7-methyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
SpectraBase Compound ID 7VkR3obG6aC
InChI InChI=1S/C21H27N3O/c1-3-4-9-21-13-23-11-20(2,19(21)25)12-24(14-21)18(23)16-10-22-17-8-6-5-7-15(16)17/h5-8,10,18,22H,3-4,9,11-14H2,1-2H3/t18-,20-,21+
InChIKey SZRSIATVIOGPPD-ZKTXZKFHSA-N
Mol Weight 337.47 g/mol
Molecular Formula C21H27N3O
Exact Mass 337.215413 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DQs2eaNQgFF
Name 5-butyl-2-(1H-indol-3-yl)-7-methyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
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/C21H27N3O/c1-3-4-9-21-13-23-11-20(2,19(21)25)12-24(14-21)18(23)16-10-22-17-8-6-5-7-15(16)17/h5-8,10,18,22H,3-4,9,11-14H2,1-2H3/t18-,20-,21+
InChIKey SZRSIATVIOGPPD-ZKTXZKFHSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27227
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: D75682; Labnumber: AENIC71-0604; SBI_ID: SBI-027231
Temperature 306 °C