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12-EPI-FISCHERINDOLE-I-ISONITRILE
SpectraBase Compound ID EW70ubAusvE
InChI InChI=1S/C21H22ClN2/c1-6-21(4)15(22)11-13-17(19(21)23-5)16-12-9-7-8-10-14(12)24-18(16)20(13,2)3/h5-10,13,15,24H,1,11H2,2-4H3/q+1/t13-,15+,21+/m0/s1
InChIKey HHOJVUOXRNUKAA-QDUSTFBWSA-N
Mol Weight 337.87 g/mol
Molecular Formula C21H22ClN2
Exact Mass 337.147151 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EbpNYUVb5Dr
Name 12-EPI-FISCHERINDOLE-I-ISONITRILE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22ClN2
InChI InChI=1S/C21H22ClN2/c1-6-21(4)15(22)11-13-17(19(21)23-5)16-12-9-7-8-10-14(12)24-18(16)20(13,2)3/h5-10,13,15,24H,1,11H2,2-4H3/q+1/t13-,15+,21+/m0/s1
InChIKey HHOJVUOXRNUKAA-QDUSTFBWSA-N
Literature Reference Author K.STRATMAN,R.E.MOORE,R.BONJOUKLIAN,J.B.DEETER,G.M.L.PATTERSO N,S.SHAFFER,C.D.SMIT
Literature Reference Citation J.AM.CHEM.SOC.,116,9935(1994)
Literature Reference DOI 10.1021/ja00101a015
Molecular Weight 337.872 g/mol
Solvent CD2Cl2
Source File Reference UWSI176