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2,3-Dimethyl-3-isopropyl-heptanonitrile
SpectraBase Compound ID BRh5JGy6Dkv
InChI InChI=1S/C12H23N/c1-6-7-8-12(5,10(2)3)11(4)9-13/h10-11H,6-8H2,1-5H3
InChIKey ABPKDVCZCMBPJN-UHFFFAOYSA-N
Mol Weight 181.32 g/mol
Molecular Formula C12H23N
Exact Mass 181.18305 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 45ck2hCiaFt
Name 2,3-Dimethyl-3-isopropyl-heptanonitrile
CAS Registry Number 75437-45-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H23N
InChI InChI=1S/C12H23N/c1-6-7-8-12(5,10(2)3)11(4)9-13/h10-11H,6-8H2,1-5H3
InChIKey ABPKDVCZCMBPJN-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference R.M. Schwarz, N. Rabjohn, Org. Magn. Resonance 13, 9 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4