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2,6-dioxo-7-(hydroxymethyl)-1-methyl-1,2,3,6-tetrahydrofurine-3-propionitrile, pivalate(ester)
SpectraBase Compound ID Fv3KR0ToDPS
InChI InChI=1S/C15H19N5O4/c1-15(2,3)13(22)24-9-19-8-17-11-10(19)12(21)18(4)14(23)20(11)7-5-6-16/h8H,5,7,9H2,1-4H3
InChIKey ZBJCNMLKEJMOHC-UHFFFAOYSA-N
Mol Weight 333.35 g/mol
Molecular Formula C15H19N5O4
Exact Mass 333.143704 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 2ePoC8EXFc8
Name 2,6-DIOXO-7-(HYDROXYMETHYL)-1-METHYL-1,2,3,6-TETRAHYDROPURINE-3-PROPIONITRILE, PIVALATE (ESTER)
Source of Sample M. Hu, Syva Company, Palo Alto, California
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19N5O4
InChI InChI=1S/C15H19N5O4/c1-15(2,3)13(22)24-9-19-8-17-11-10(19)12(21)18(4)14(23)20(11)7-5-6-16/h8H,5,7,9H2,1-4H3
InChIKey ZBJCNMLKEJMOHC-UHFFFAOYSA-N
Literature Reference J. ORG. CHEM. 45, 1711(1980) Abstract-Chemical Abstracts= 92, 198358(1980)
Melting Point 118-120C
Molecular Weight 333.347992
Synonyms PURINE-3-PROPIONITRILE, 2,6-DIOXO- 7-/HYDROXYMETHYL/-1-METHYL-1,2,3,6- TETRAHYDRO-, PIVALATE /ESTER/
Technique FILM (CAST FROM CHCl3)