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2,4-DI-TERT.-BUTYL-6-METHYL-R-2,TRANS-5,CIS-6-TRINITROCYCLOHEX-3-ENONE
SpectraBase Compound ID 9Nij8IyDWfc
InChI InChI=1S/C15H23N3O7/c1-12(2,3)9-8-15(18(24)25,13(4,5)6)11(19)14(7,17(22)23)10(9)16(20)21/h8,10H,1-7H3/t10-,14+,15-/m1/s1
InChIKey WWLXNOYLTWNSJS-WKPIXPDZSA-N
Mol Weight 357.36 g/mol
Molecular Formula C15H23N3O7
Exact Mass 357.1536 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I5VPqkVTTq0
Name 2,4-DI-TERT.-BUTYL-6-METHYL-R-2,TRANS-5,CIS-6-TRINITROCYCLOHEX-3-ENONE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H23N3O7
InChI InChI=1S/C15H23N3O7/c1-12(2,3)9-8-15(18(24)25,13(4,5)6)11(19)14(7,17(22)23)10(9)16(20)21/h8,10H,1-7H3/t10-,14+,15-/m1/s1
InChIKey WWLXNOYLTWNSJS-WKPIXPDZSA-N
Literature Reference Author M.P.HARTSHORN,W.T.ROBINSON,K.H.SUTTON,J.VAUGHAN
Literature Reference Citation AUSTR.J.CHEM.,38,161(1985)
Literature Reference DOI 10.1071/ch9850161
Molecular Weight 357.364 g/mol
Solvent ACETONE-D6
Source File Reference UWED141