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(+)-(2S)-1,2,2-TRIMETHYLPROPYL-ISOCYANATE
SpectraBase Compound ID 7jH05ZkvzJu
InChI InChI=1S/C7H13NO/c1-6(8-5-9)7(2,3)4/h6H,1-4H3/t6-/m1/s1
InChIKey LRPJWPWEUDBUCU-ZCFIWIBFSA-N
Mol Weight 127.19 g/mol
Molecular Formula C7H13NO
Exact Mass 127.099714 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hg6VqFXxSIm
Name (+)-(2S)-1,2,2-TRIMETHYLPROPYL-ISOCYANATE
Compound Number 2 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H13NO
InChI InChI=1S/C7H13NO/c1-6(8-5-9)7(2,3)4/h6H,1-4H3/t6-/m1/s1
InChIKey LRPJWPWEUDBUCU-ZCFIWIBFSA-N
Literature Reference Author M.C.SCHOPOHL,A.FAUST,D.MIRK,R.FROEHLICH,O.KATAEVA,S.R.WALDVO GEL
Literature Reference Citation EUR.J.ORG.CHEM.,2987(2005)
Molecular Weight 127.186 g/mol
Sample ID 29780
Solvent CDCl3