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2,2'-anhydro-1-(beta-D-arabinofuranosyl)cytosine, 3',5'-ditetracosanoate, compound with hydrogen tetrafluoroborate(1:1)
SpectraBase Compound ID 3fheFn1pdQt
InChI InChI=1S/C57H103N3O6.BF4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-52(61)63-49-50-54(55-56(64-50)60-48-47-51(58)59-57(60)66-55)65-53(62)46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;2-1(3,4)5/h47-48,50,54-56,58H,3-46,49H2,1-2H3;/q;-1/t50-,54-,55+,56-;/m1./s1
InChIKey QVHYLYOEYDQUDW-RHGWLWGGSA-N
Mol Weight 1014.3 g/mol
Molecular Formula C57H104BF4N3O6
Exact Mass 1013.795431 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID LN8uoeICeF3
Name 2,2'-ANHYDRO-1-(beta-D-ARABINOFURANOSYL)CYTOSINE, 3',5'-DITETRACOSANOATE, COMPOUND WITH HYDROGEN TETRAFLUOROBORATE (1:1)
Source of Sample K. Kondo, Tanabe Seiyaku Company Ltd., Osaka, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C57H104BF4N3O6
InChI InChI=1S/C57H103N3O6.BF4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-52(61)63-49-50-54(55-56(64-50)60-48-47-51(58)59-57(60)66-55)65-53(62)46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;2-1(3,4)5/h47-48,50,54-56,58H,3-46,49H2,1-2H3;/q;-1/t50-,54-,55+,56-;/m1./s1
InChIKey QVHYLYOEYDQUDW-RHGWLWGGSA-N
Literature Reference J. ORG. CHEM. 42, 2809(1977) Abstract-Chemical Abstracts= 87, 118032(1977)
Melting Point 203-204C
Molecular Weight 1014.283997
Synonyms CYTOSINE, 2,2*-ANHYDRO-1-/B-D- ARABINOFURANOSYL/-, 3*,5*-DITETRACOSAN- OATE, CMPD WITH HYDROGEN TETRAFLUORO- BORATE /1 TO 1/
Technique FILM (CAST FROM ACETONE)