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3-Isopropyl-3-methyl-heptanonitrile
SpectraBase Compound ID 6XkKLNyQ9Is
InChI InChI=1S/C11H21N/c1-5-6-7-11(4,8-9-12)10(2)3/h10H,5-8H2,1-4H3
InChIKey KAGJIKIIARMELJ-UHFFFAOYSA-N
Mol Weight 167.3 g/mol
Molecular Formula C11H21N
Exact Mass 167.1674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BJS9W01wNG
Name 3-Isopropyl-3-methyl-heptanonitrile
CAS Registry Number 75437-44-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H21N
InChI InChI=1S/C11H21N/c1-5-6-7-11(4,8-9-12)10(2)3/h10H,5-8H2,1-4H3
InChIKey KAGJIKIIARMELJ-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