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3-({[(1R,3S)-3-isobutyl-2,2-dimethylcyclopropyl]methyl}amino)-2-cyclohexen-1-one
SpectraBase Compound ID 67pYzNMnzk1
InChI InChI=1S/C16H27NO/c1-11(2)8-14-15(16(14,3)4)10-17-12-6-5-7-13(18)9-12/h9,11,14-15,17H,5-8,10H2,1-4H3
InChIKey CMDXZZQSSAUTIA-UHFFFAOYSA-N
Mol Weight 249.4 g/mol
Molecular Formula C16H27NO
Exact Mass 249.209264 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4oXYOUW0Dls
Name 3-({[(1R,3S)-3-isobutyl-2,2-dimethylcyclopropyl]methyl}amino)-2-cyclohexen-1-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/C16H27NO/c1-11(2)8-14-15(16(14,3)4)10-17-12-6-5-7-13(18)9-12/h9,11,14-15,17H,5-8,10H2,1-4H3
InChIKey CMDXZZQSSAUTIA-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_3352
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: 115988; Labnumber: NC98RN83-109; VK_ID: VK-003353
Synonyms 3-({[3-isobutyl-2,2-dimethylcyclopropyl]methyl}amino)-2-cyclohexen-1-one
Temperature 308 °C