Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C8H11N5O/c1-3-12-4-7-5-13(6(2)14)11-9-8(7)10-12/h4H,3,5H2,1-2H3
SMILES	CCn1nc2c(c1)CN(N=N2)C(=O)C
InChI Key	AHUQBMJJIBAFGD-UHFFFAOYSA-N
Molecular Formula	C8H11N5O
Exact Mass	193.206 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/AHUQBMJJIBAFGD-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/AHUQBMJJIBAFGD-UHFFFAOYSA-N/CHMO0000593
Version
Author	Nicolai Wippert
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T04:51:52.046328
MetadataModified	2024-09-07T20:10:37.945276
MetadataPublished	2021-07-11
Related Molecule

Field	Value
Measurement Technique	1H nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
155928558	PubChem
The data in this table is sourced from UniChem at EBI.