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3,24:6,9:12,15:18,21-TETRAKIS[ENDO,ENDO-1,2-DIMETHOXYCARBONYL-3,5-CYCLOPENTYLIDENO]-1,2,4,5,7,8,10,11,13,14,16,17,19,20,22,23-HEXADECAOXACYCLOTETRACOSANE
SpectraBase Compound ID 8vot2MoWB5H
InChI InChI=1S/C44H56O32/c1-53-29(45)21-13-9-14(22(21)30(46)54-2)38-62-61-37(13)69-71-39-15-10-17(25(33(49)57-5)23(15)31(47)55-3)41(65-63-39)73-75-43-19-12-20(28(36(52)60-8)27(19)35(51)59-7)44(68-67-43)76-74-42-18-11-16(40(64-66-42)72-70-38)24(32(48)56-4)26(18)34(50)58-6/h13-28,37-44H,9-12H2,1-8H3/t13-,14+,15+,16-,17-,18+,19+,20-,21-,22+,23+,24-,25-,26+,27+,28-,37?,38?,39?,40?,41?,42?,43?,44?
InChIKey BQBJNHMNDKELAI-PEGNHWKZSA-N
Mol Weight 1096.9 g/mol
Molecular Formula C44H56O32
Exact Mass 1096.27547 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7gnWJemuSVc
Name 3,24:6,9:12,15:18,21-TETRAKIS[ENDO,ENDO-1,2-DIMETHOXYCARBONYL-3,5-CYCLOPENTYLIDENO]-1,2,4,5,7,8,10,11,13,14,16,17,19,20,22,23-HEXADECAOXACYCLOTETRACOSANE
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Formula C44H56O32
InChI InChI=1S/C44H56O32/c1-53-29(45)21-13-9-14(22(21)30(46)54-2)38-62-61-37(13)69-71-39-15-10-17(25(33(49)57-5)23(15)31(47)55-3)41(65-63-39)73-75-43-19-12-20(28(36(52)60-8)27(19)35(51)59-7)44(68-67-43)76-74-42-18-11-16(40(64-66-42)72-70-38)24(32(48)56-4)26(18)34(50)58-6/h13-28,37-44H,9-12H2,1-8H3/t13-,14+,15+,16-,17-,18+,19+,20-,21-,22+,23+,24-,25-,26+,27+,28-,37?,38?,39?,40?,41?,42?,43?,44?
InChIKey BQBJNHMNDKELAI-PEGNHWKZSA-N
Instrument Name Bruker WH-90
Literature Reference V.N.ODINOKOV, O.S.KUKOVINETS, G.A.TOLSTIKOV (1978) Zhurn.Org.Khim.(Russ.Lang.): v.14, N6, 1209-1220.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3H6O acetone