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2,2'-anhydro-1-(ß-D-arabinofuranosyl)cytosine, 3',5'-bis-(1-adamantanecarboxylate), compound with hydrogen tetrafluoroborate(1:1)

View entire compound with spectra: 1 NMR, and 1 FTIR

2,2'-anhydro-1-(ß-D-arabinofuranosyl)cytosine, 3',5'-bis-(1-adamantanecarboxylate), compound with hydrogen tetrafluoroborate(1:1)
SpectraBase Compound ID 9Mo7ofvjmdk
InChI InChI=1S/C31H39N3O6.BF4/c32-23-1-2-34-26-25(40-29(34)33-23)24(39-28(36)31-12-19-6-20(13-31)8-21(7-19)14-31)22(38-26)15-37-27(35)30-9-16-3-17(10-30)5-18(4-16)11-30;2-1(3,4)5/h1-2,16-22,24-26,32H,3-15H2;/q;-1/t16-,17+,18-,19-,20+,21-,22-,24-,25+,26-,30-,31-;/m1./s1
InChIKey CARXARGMYKGZKT-BMVAPNTOSA-N
Mol Weight 637.5 g/mol
Molecular Formula C31H40BF4N3O6
Exact Mass 637.294629 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID HuVFRAueS7L
Name 2,2'-ANHYDRO-1-(beta-D-ARABINOFURANOSYL)CYTOSINE, 3',5'-BIS(1-ADAMANTANE-CARBOXYLATE), 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 C31H40BF4N3O6
InChI InChI=1S/C31H39N3O6.BF4/c32-23-1-2-34-26-25(40-29(34)33-23)24(39-28(36)31-12-19-6-20(13-31)8-21(7-19)14-31)22(38-26)15-37-27(35)30-9-16-3-17(10-30)5-18(4-16)11-30;2-1(3,4)5/h1-2,16-22,24-26,32H,3-15H2;/q;-1/t16-,17+,18-,19-,20+,21-,22-,24-,25+,26-,30-,31-;/m1./s1
InChIKey CARXARGMYKGZKT-BMVAPNTOSA-N
Literature Reference J. ORG. CHEM. 42, 2809(1977) Abstract-Chemical Abstracts= 87, 118032(1977)
Melting Point 285-286C
Molecular Weight 637.479 g/mol
Synonyms CYTOSINE, 2,2*-ANHYDRO-1-/B-D- ARABINOFURANOSYL/-, 3*,5*-BIS- /1-ADAMANTANECARBOXYLATE/, CMPD WITH HYDROGEN TETRAFLUOROBORATE /1 TO 1/
Technique KBr WAFER