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6E-Hydroximinogorgost-4-en-3-one
SpectraBase Compound ID 97IJsnpeQsA
InChI InChI=1S/C30H47NO2/c1-17(2)19(4)30(7)16-26(30)18(3)22-8-9-23-21-15-27(31-33)25-14-20(32)10-12-29(25,6)24(21)11-13-28(22,23)5/h14,17-19,21-24,26,33H,8-13,15-16H2,1-7H3/b31-27+/t18-,19-,21-,22+,23-,24-,26+,28+,29+,30-/m0/s1
InChIKey FYUXFBBUEVJZOO-FXXOCAIVSA-N
Mol Weight 453.7 g/mol
Molecular Formula C30H47NO2
Exact Mass 453.36068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8MMEMDRXdPR
Name 6-(E)-HYDROXIMINO-GORGOST-4-EN-3-ONE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H46NO2
InChI InChI=1S/C30H47NO2/c1-17(2)19(4)30(7)16-26(30)18(3)22-8-9-23-21-15-27(31-33)25-14-20(32)10-12-29(25,6)24(21)11-13-28(22,23)5/h14,17-19,21-24,26,33H,8-13,15-16H2,1-7H3/b31-27+/t18-,19-,21-,22+,23-,24-,26+,28+,29+,30-/m0/s1
InChIKey FYUXFBBUEVJZOO-FXXOCAIVSA-N
Literature Reference Author N.DEIVE,J.RODRIGUEZ,C.JIMENEZ
Literature Reference Citation J.MED.CHEM.,44,2612(2001)
Literature Reference DOI 10.1021/jm010867n
Molecular Weight 452.701 g/mol
Sample ID 44668
Solvent CDCl3