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VDHGQFPJTXHBTA-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

VDHGQFPJTXHBTA-UHFFFAOYSA-N
SpectraBase Compound ID JVMHf9rUfCW
InChI InChI=1S/C54H73N3O6/c1-51(2,3)41-23-33-19-37-27-43(53(7,8)9)29-39-21-35-25-42(52(4,5)6)26-36(48(35)61)22-40-30-44(54(10,11)12)28-38(20-34(24-41)47(33)60)50(40)63-32-46(59)57-18-14-16-55-15-13-17-56-45(58)31-62-49(37)39/h23-30,55,60-61H,13-22,31-32H2,1-12H3,(H,56,58)(H,57,59)
InChIKey VDHGQFPJTXHBTA-UHFFFAOYSA-N
Mol Weight 860.2 g/mol
Molecular Formula C54H73N3O6
Exact Mass 859.549937 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6AkiDvCKcSI
Name VDHGQFPJTXHBTA-UHFFFAOYSA-N
Compound Number 6D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C54H73N3O6
InChI InChI=1S/C54H73N3O6/c1-51(2,3)41-23-33-19-37-27-43(53(7,8)9)29-39-21-35-25-42(52(4,5)6)26-36(48(35)61)22-40-30-44(54(10,11)12)28-38(20-34(24-41)47(33)60)50(40)63-32-46(59)57-18-14-16-55-15-13-17-56-45(58)31-62-49(37)39/h23-30,55,60-61H,13-22,31-32H2,1-12H3,(H,56,58)(H,57,59)
InChIKey VDHGQFPJTXHBTA-UHFFFAOYSA-N
Literature Reference Author R.OSTASZEWSKI,T.W.STEVENS,W.VERBOOM,D.N.REINHOUDT,F.M.KASPER SEN
Literature Reference Citation REC.TR.CH.P.-B.,110,294(1991)
Literature Reference DOI 10.1002/recl.19911100608
Molecular Weight 860.190 g/mol
Solvent CDCl3
Source File Reference UWCS21186