Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C9H9N5/c1-13-6-9-10-11-12-14(9)8-5-3-2-4-7(8)13/h2-5H,6H2,1H3
SMILES	CN1Cc2nnnn2-c2c1cccc2
InChI Key	VJXDMNNLLZYTRN-UHFFFAOYSA-N
Molecular Formula	C9H9N5
Exact Mass	187.201 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement

Field	Value
DOI	10.14272/VJXDMNNLLZYTRN-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/VJXDMNNLLZYTRN-UHFFFAOYSA-N/CHMO0000593
Version
Author	Laura Holzhauer
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T06:07:20.999434
MetadataModified	2024-09-07T21:48:20.965567
MetadataPublished	2022-02-11

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