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2,2,4,4,5,7,7-D7-CHOLESTANE

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2,2,4,4,5,7,7-D7-CHOLESTANE
SpectraBase Compound ID EA6IIVEUsyX
InChI InChI=1S/C27H48/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h19-25H,6-18H2,1-5H3/t20-,21?,22+,23-,24+,25+,26+,27-/m1/s1/i7D2,11D2,13D2,21D
InChIKey XIIAYQZJNBULGD-KWNOJJHDSA-N
Mol Weight 379.7 g/mol
Molecular Formula C27H412H7
Exact Mass 379.419539 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2HIwdUx2B08
Name 2,2,4,4,5,7,7-D7-CHOLESTANE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H412H7
InChI InChI=1S/C27H48/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h19-25H,6-18H2,1-5H3/t20-,21?,22+,23-,24+,25+,26+,27-/m1/s1/i7D2,11D2,13D2,21D
InChIKey XIIAYQZJNBULGD-KWNOJJHDSA-N
Literature Reference Author M.G.D.MIRANDA,A.L.M.ALBERT,J.N.CARDOSO,R.S.C.LOPES,C.C.LOPES
Literature Reference Citation QUIM.NOVA,36,1160(2013)
Literature Reference DOI 10.1590/s0100-40422013000800014
Molecular Weight 379.721 g/mol
Solvent CDCl3
Source File Reference UWIR12034