Dataset

heteronuclear multiple bond coherence (HMBC)

Chemical Info

InChI	InChI=1S/C16H17ClN6O2/c1-3-4-5-12-10-21(20-18-12)16-8-11(2)22(19-16)15-7-6-13(23(24)25)9-14(15)17/h6-10H,3-5H2,1-2H3
SMILES	CCCCc1nnn(c1)c1nn(c(c1)C)c1ccc(cc1Cl)[N+](=O)[O-]
InChI Key	JCVTZTZCOPFHML-UHFFFAOYSA-N
Molecular Formula	C16H17ClN6O2
Exact Mass	360.798 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/JCVTZTZCOPFHML-UHFFFAOYSA-N/CHMO0000601
License URL
Source	https://www.chemotion-repository.net/inchikey/JCVTZTZCOPFHML-UHFFFAOYSA-N/CHMO0000601
Version
Author	Nicolai Wippert
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T02:39:25.345032
MetadataModified	2024-09-08T02:39:25.345037
MetadataPublished	2024-02-14

Field	Value
Measurement Technique	heteronuclear multiple bond coherence
Measurement Variables

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.