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3-(2,6,6-Trimethyl-1-cyclohexenyl)-propenonitrile
SpectraBase Compound ID 9P988xQazdX
InChI InChI=1S/C12H17N/c1-10-6-4-8-12(2,3)11(10)7-5-9-13/h5,7H,4,6,8H2,1-3H3/b7-5+
InChIKey KRFUZADFDPVFRO-FNORWQNLSA-N
Mol Weight 175.27 g/mol
Molecular Formula C12H17N
Exact Mass 175.1361 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LdMt2n8lhDN
Name 3-(2,6,6-Trimethyl-1-cyclohexenyl)-propenonitrile
CAS Registry Number 40244-29-9
Comments WHE-6875-73
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H17N
InChI InChI=1S/C12H17N/c1-10-6-4-8-12(2,3)11(10)7-5-9-13/h5,7H,4,6,8H2,1-3H3/b7-5+
InChIKey KRFUZADFDPVFRO-FNORWQNLSA-N
Instrument Name Bruker WP-80
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3