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N-(3-THENYL)ADENINE

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N-(3-THENYL)ADENINE
SpectraBase Compound ID 2R1Q3PLwNM1
InChI InChI=1S/C10H9N5S/c1-2-16-4-7(1)3-11-9-8-10(13-5-12-8)15-6-14-9/h1-2,4-6H,3H2,(H2,11,12,13,14,15)
InChIKey YSANEOBAJIAOIO-UHFFFAOYSA-N
Mol Weight 231.28 g/mol
Molecular Formula C10H9N5S
Exact Mass 231.057866 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4WZnr1JKzzE
Name N-(3-THENYL)ADENINE
Source of Sample A. Hardt, W. Bremser BASF Ludwigshafen (1984)
CAS Registry Number 525-81-5
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9N5S
InChI InChI=1S/C10H9N5S/c1-2-16-4-7(1)3-11-9-8-10(13-5-12-8)15-6-14-9/h1-2,4-6H,3H2,(H2,11,12,13,14,15)
InChIKey YSANEOBAJIAOIO-UHFFFAOYSA-N
Molecular Weight 231.28
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Bruker AM-270
Synonyms ADENINE, N-/3-THENYL/-,