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5-butyl-2-(4-ethylphenyl)-7-methyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
SpectraBase Compound ID KlAwVkWUnDY
InChI InChI=1S/C21H30N2O/c1-4-6-11-21-14-22-12-20(3,19(21)24)13-23(15-21)18(22)17-9-7-16(5-2)8-10-17/h7-10,18H,4-6,11-15H2,1-3H3/t18-,20-,21+
InChIKey RRXBWDQPCQYJQG-ZKTXZKFHSA-N
Mol Weight 326.48 g/mol
Molecular Formula C21H30N2O
Exact Mass 326.235814 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5MRGIdxzOwl
Name 5-butyl-2-(4-ethylphenyl)-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/C21H30N2O/c1-4-6-11-21-14-22-12-20(3,19(21)24)13-23(15-21)18(22)17-9-7-16(5-2)8-10-17/h7-10,18H,4-6,11-15H2,1-3H3/t18-,20-,21+
InChIKey RRXBWDQPCQYJQG-ZKTXZKFHSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_12477
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: D75658; Labnumber: AENIC71-0578; SBI_ID: SBI-012480
Temperature 308 °C