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3-Adamantan-1-yl-3-oxo-propionitrile

View entire compound with spectra: 1 MS (GC)

3-Adamantan-1-yl-3-oxo-propionitrile
SpectraBase Compound ID 6pIOqPtI6I
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
InChIKey ALVFKYUPAPUUIU-UHFFFAOYSA-N
Mol Weight 203.28 g/mol
Molecular Formula C13H17NO
Exact Mass 203.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7aDSyXpDI2R
Name 3-Adamantan-1-yl-3-oxo-propionitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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
InChIKey ALVFKYUPAPUUIU-UHFFFAOYSA-N
Molecular Weight 203.285 g/mol
SMILES C12(C(=O)CC#N)CC3CC(C2)CC(C1)C3
SPLASH splash10-000i-4900000000-cdcf256f595f9d684b26
Synonyms 3-(1-adamantyl)-3-keto-propionitrile 3-(1-adamantyl)-3-oxidanylidene-propanenitrile 3-(1-adamantyl)-3-oxo-propanenitrile
Wiley ID 1464214