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1-[(1R*,3AR*,7AS*)-HEXAHYDRO-3A-METHYL-7-METHYLENE-1-INDANYL]-2-METHYLPROPENYL-ISOTHIOCYANATE
SpectraBase Compound ID IPlW2OTvjS1
InChI InChI=1S/C16H23NS/c1-11(2)15(17-10-18)13-7-9-16(4)8-5-6-12(3)14(13)16/h13-14H,3,5-9H2,1-2,4H3/t13-,14+,16-/m0/s1
InChIKey VFUDZKKVUZCAQY-LZWOXQAQSA-N
Mol Weight 261.43 g/mol
Molecular Formula C16H23NS
Exact Mass 261.155121 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5SP2QaCOmVB
Name 1-[(1R*,3AR*,7AS*)-HEXAHYDRO-3A-METHYL-7-METHYLENE-1-INDANYL]-2-METHYLPROPENYL-ISOTHIOCYANATE
CAS Registry Number 127516-54-5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H23NS
InChI InChI=1S/C16H23NS/c1-11(2)15(17-10-18)13-7-9-16(4)8-5-6-12(3)14(13)16/h13-14H,3,5-9H2,1-2,4H3/t13-,14+,16-/m0/s1
InChIKey VFUDZKKVUZCAQY-LZWOXQAQSA-N
Literature Reference Author B.CHENERA,C.P.CHUANG,D.J.HART,C.S.LAI
Literature Reference Citation J.ORG.CHEM.,57,2018(1992)
Literature Reference DOI 10.1021/jo00033a023
Molecular Weight 261.425 g/mol
Solvent CDCl3
Source File Reference UWCS2297