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3-Nitro-P-isomenthane

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3-Nitro-P-isomenthane
SpectraBase Compound ID KKkgctUBkDo
InChI InChI=1S/C10H19NO2/c1-7(2)9-5-4-8(3)6-10(9)11(12)13/h7-10H,4-6H2,1-3H3/t8-,9-,10+/m1/s1
InChIKey YMSHVZLASIYIKR-BBBLOLIVSA-N
Mol Weight 185.27 g/mol
Molecular Formula C10H19NO2
Exact Mass 185.141579 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID jMZoQh2SdM
Name 3-Nitro-P-isomenthane
CAS Registry Number 5033-86-3
Comments *1R,3S,4R
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H19NO2
InChI InChI=1S/C10H19NO2/c1-7(2)9-5-4-8(3)6-10(9)11(12)13/h7-10H,4-6H2,1-3H3/t8-,9-,10+/m1/s1
InChIKey YMSHVZLASIYIKR-BBBLOLIVSA-N
Instrument Name Bruker HX-90
Literature Reference J. Firl, G. Kresze, Liebigs Ann. Chem. 87 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3