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(C2)4-[G-2]-OHDS

View entire compound with spectra: 1 NMR

(C2)4-[G-2]-OHDS
SpectraBase Compound ID 1RMwhnIdBkL
InChI InChI=1S/C92H110N4O13S/c1-14-19-20-21-22-23-24-25-26-27-28-29-30-31-32-110(101,102)109-76-48-72(58-103-74-44-68(54-93(15-2)81-50-85-77(33-64(81)10)60(6)37-89(97)105-85)41-69(45-74)55-94(16-3)82-51-86-78(34-65(82)11)61(7)38-90(98)106-86)43-73(49-76)59-104-75-46-70(56-95(17-4)83-52-87-79(35-66(83)12)62(8)39-91(99)107-87)42-71(47-75)57-96(18-5)84-53-88-80(36-67(84)13)63(9)40-92(100)108-88/h33-53H,14-32,54-59H2,1-13H3
InChIKey NXPBBWYQHIGQAT-UHFFFAOYSA-N
Mol Weight 1512.0 g/mol
Molecular Formula C92H110N4O13S
Exact Mass 1510.779011 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DxUdgX4ZO3O
Name (C2)4-[G-2]-OHDS
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C92H110N4O13S
InChI InChI=1S/C92H110N4O13S/c1-14-19-20-21-22-23-24-25-26-27-28-29-30-31-32-110(101,102)109-76-48-72(58-103-74-44-68(54-93(15-2)81-50-85-77(33-64(81)10)60(6)37-89(97)105-85)41-69(45-74)55-94(16-3)82-51-86-78(34-65(82)11)61(7)38-90(98)106-86)43-73(49-76)59-104-75-46-70(56-95(17-4)83-52-87-79(35-66(83)12)62(8)39-91(99)107-87)42-71(47-75)57-96(18-5)84-53-88-80(36-67(84)13)63(9)40-92(100)108-88/h33-53H,14-32,54-59H2,1-13H3
InChIKey NXPBBWYQHIGQAT-UHFFFAOYSA-N
Literature Reference Author S.L.GILAT,A.ADRONOV,J.M.J.FRECHET
Literature Reference Citation J.ORG.CHEM.,64,7474(1999)
Literature Reference DOI 10.1021/jo990776m
Molecular Weight 1511.964 g/mol
Sample ID 60109
Solvent CDCl3