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2,6-dioxo-1-methyl-1,2,3,6-tetrahydropurine-3-propionitrile
SpectraBase Compound ID H7jkcNSHOnX
InChI InChI=1S/C9H9N5O2/c1-13-8(15)6-7(12-5-11-6)14(9(13)16)4-2-3-10/h5H,2,4H2,1H3,(H,11,12)
InChIKey QAZZWARVZVWTHY-UHFFFAOYSA-N
Mol Weight 219.2 g/mol
Molecular Formula C9H9N5O2
Exact Mass 219.075625 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID Ls918R8VsqD
Name 2,6-DIOXO-1-METHYL-1,2,3,6-TETRAHYDROPURINE-3-PROPIONITRILE
Source of Sample M. Hu, Syva Company, Palo Alto, California
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9N5O2
InChI InChI=1S/C9H9N5O2/c1-13-8(15)6-7(12-5-11-6)14(9(13)16)4-2-3-10/h5H,2,4H2,1H3,(H,11,12)
InChIKey QAZZWARVZVWTHY-UHFFFAOYSA-N
Literature Reference J. ORG. CHEM. 45, 1711(1980) Abstract-Chemical Abstracts= 92, 198358(1980)
Melting Point 229-230C
Molecular Weight 219.203995
Synonyms PURINE-3-PROPIONITRILE, 2,6-DIOXO- 1-METHYL-1,2,3,6-TETRAHYDRO-,
Technique KBr WAFER