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β-Oxo-1-adamantanepropionitrile

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β-Oxo-1-adamantanepropionitrile
SpectraBase Compound ID K672pYMyF7f
InChI InChI=1S/C13H17NO/c14-2-1-12(15)13-6-9-3-10(7-13)5-11(4-9)8-13/h9-11H,1,3-8H2/t9-,10+,11-,13-
InChIKey ALVFKYUPAPUUIU-DNSLJTBWSA-N
Mol Weight 203.28 g/mol
Molecular Formula C13H17NO
Exact Mass 203.131014 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FOBv85OWwWo
Name tricyclo[3.3.1.1~3,7~]decane-1-propanenitrile, beta-oxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 203.131014170 u
Formula C13H17NO
InChI InChI=1S/C13H17NO/c14-2-1-12(15)13-6-9-3-10(7-13)5-11(4-9)8-13/h9-11H,1,3-8H2/t9-,10+,11-,13-
InChIKey ALVFKYUPAPUUIU-DNSLJTBWSA-N
Molecular Weight 203.285 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_646
Solvent DMSO-d6
Source Vendor ID: NMR/13239217