Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Info

InChI	InChI=1S/C12H18N4O2/c1-9(2)15(10(3)4)14-13-11-5-7-12(8-6-11)16(17)18/h5-10H,1-4H3/b14-13+
SMILES	CC(N(C(C)C)/N=N/c1ccc(cc1)[N+](=O)[O-])C
InChI Key	ZACKTSVIIOMNNP-BUHFOSPRSA-N
Molecular Formula	C12H18N4O2
Exact Mass	250.297 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/ZACKTSVIIOMNNP-BUHFOSPRSA-N/NMR/13C/CDCL3/100
License URL
Source	https://www.chemotion-repository.net/inchikey/ZACKTSVIIOMNNP-BUHFOSPRSA-N/NMR/13C/CDCL3/100
Version
Author	Andreas Hafner
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T22:38:16.763309
MetadataModified	2024-09-07T11:59:47.165755
MetadataPublished	2014-05-27

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
ZINC000018116077	ZINC
The data in this table is sourced from UniChem at EBI.