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3,6-dihydro-3,7-dimethyl-2,6-dioxopurine-1(2H)-acetic acid, phenyl ester
SpectraBase Compound ID 4I1GaozaqGW
InChI InChI=1S/C15H14N4O4/c1-17-9-16-13-12(17)14(21)19(15(22)18(13)2)8-11(20)23-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
InChIKey BJWAUUWECXDFIB-UHFFFAOYSA-N
Mol Weight 314.3 g/mol
Molecular Formula C15H14N4O4
Exact Mass 314.101505 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID AF2lRjJ8qUy
Name 3,6-DIHYDRO-3,7-DIMETHYL-2,6-DIOXOPURINE-1(2H)-ACETIC ACID, PHENYL ESTER
Source of Sample F. Banci, Dott. R. Ravasini & Cia, Rome, Italy
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14N4O4
InChI InChI=1S/C15H14N4O4/c1-17-9-16-13-12(17)14(21)19(15(22)18(13)2)8-11(20)23-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
InChIKey BJWAUUWECXDFIB-UHFFFAOYSA-N
Literature Reference Abstract-Chemical Abstracts= 69, 43890(1968)
Melting Point 159-161C
Molecular Weight 314.300995
Synonyms PURINE-1/2H/-ACETIC ACID, 3,6-DI- HYDRO-3,7-DIMETHYL-2,6-DIOXO-, PHENYL ESTER 1-THEOBROMINEACETIC ACID, PHENYL ESTER
Technique KBr WAFER