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5'-TRITYLDEOXYTHYMIDINE-3'-BIS(1,2,4-TRIAZOLIDO)PHOSPHATE
SpectraBase Compound ID 6kQPJFHUdaT
InChI InChI=1S/C33H33N8O6P/c1-24-18-39(32(43)38-31(24)42)30-17-28(47-48(44,40-22-34-20-36-40)41-23-35-21-37-41)29(46-30)19-45-33(25-11-5-2-6-12-25,26-13-7-3-8-14-26)27-15-9-4-10-16-27/h2-16,18,20-22,28-30H,17,19,23H2,1H3,(H,35,37)(H,38,42,43)/t28-,29+,30+,48?/m0/s1
InChIKey NIQGXLXQDDYZMQ-ZXQWDZMASA-N
Mol Weight 668.7 g/mol
Molecular Formula C33H33N8O6P
Exact Mass 668.226068 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ERshUL3lZ4u
Name 5'-TRITYLDEOXYTHYMIDINE-3'-BIS(1,2,4-TRIAZOLIDO)PHOSPHATE
Comments , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C33H33N8O6P
InChI InChI=1S/C33H33N8O6P/c1-24-18-39(32(43)38-31(24)42)30-17-28(47-48(44,40-22-34-20-36-40)41-23-35-21-37-41)29(46-30)19-45-33(25-11-5-2-6-12-25,26-13-7-3-8-14-26)27-15-9-4-10-16-27/h2-16,18,20-22,28-30H,17,19,23H2,1H3,(H,35,37)(H,38,42,43)/t28-,29+,30+,48?/m0/s1
InChIKey NIQGXLXQDDYZMQ-ZXQWDZMASA-N
Instrument Name Bruker HX-90
Literature Reference A.V.LEBEDEV, A.I.REZVUKHIN (1983) Bioorganich.Khim.(Russ. Lang.): v.9, N2, 149-185.
NMR Standard -H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C5H5N pyridine