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ISOCYANO-(1S,2S,3S,5R)-PINAN-3-YL-METHANE
SpectraBase Compound ID HKvaAbXIDvh
InChI InChI=1S/C12H20N/c1-8-9(7-13-4)5-10-6-11(8)12(10,2)3/h4,8-11H,5-7H2,1-3H3/q+1/t8-,9-,10+,11+/m0/s1
InChIKey GKIBCECIFSPFJY-UKKRHICBSA-N
Mol Weight 178.3 g/mol
Molecular Formula C12H20N
Exact Mass 178.159575 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8oXST0ZkSab
Name ISOCYANO-(1S,2S,3S,5R)-PINAN-3-YL-METHANE
CAS Registry Number 137465-91-9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H20N
InChI InChI=1S/C12H20N/c1-8-9(7-13-4)5-10-6-11(8)12(10,2)3/h4,8-11H,5-7H2,1-3H3/q+1/t8-,9-,10+,11+/m0/s1
InChIKey GKIBCECIFSPFJY-UKKRHICBSA-N
Literature Reference Author K.GOLLNICK,S.KOEGLER,D.MAURER
Literature Reference Citation J.ORG.CHEM.,57,229(1992)
Literature Reference DOI 10.1021/jo00027a041
Molecular Weight 178.297 g/mol
Solvent CDCl3
Source File Reference UWCS988