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1-(1',1'-Dimethyl-5'-oxo-hexyl)-cyclopropene-3-carbonitrile

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1-(1',1'-Dimethyl-5'-oxo-hexyl)-cyclopropene-3-carbonitrile
SpectraBase Compound ID 58fRPSXBgaD
InChI InChI=1S/C12H17NO/c1-9(14)5-4-6-12(2,3)11-7-10(11)8-13/h7,10H,4-6H2,1-3H3
InChIKey DNFPWGVGICJAFQ-UHFFFAOYSA-N
Mol Weight 191.27 g/mol
Molecular Formula C12H17NO
Exact Mass 191.131014 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8hRUbMr1D2R
Name 1-(1',1'-Dimethyl-5'-oxo-hexyl)-cyclopropene-3-carbonitrile
CAS Registry Number 99557-62-7
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C12H17NO
InChI InChI=1S/C12H17NO/c1-9(14)5-4-6-12(2,3)11-7-10(11)8-13/h7,10H,4-6H2,1-3H3
InChIKey DNFPWGVGICJAFQ-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference K. Ishii, M. Abe, M. Sakamoto, J. Chem. Soc. Perkin I 1937 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3