Dataset

heteronuclear multiple bond coherence (HMBC)

Chemical Info

InChI	InChI=1S/C6H6BrN/c1-5-3-2-4-8-6(5)7/h2-4H,1H3
SMILES	Cc1cccnc1Br
InChI Key	PZSISEFPCYMBDL-UHFFFAOYSA-N
Molecular Formula	C6H6BrN
Exact Mass	172.023 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement

Field	Value
DOI	10.14272/PZSISEFPCYMBDL-UHFFFAOYSA-N/CHMO0000601.1
License URL
Source	https://www.chemotion-repository.net/inchikey/PZSISEFPCYMBDL-UHFFFAOYSA-N/CHMO0000601.1
Version
Author	Simone Gräßle
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T01:43:09.821777
MetadataModified	2024-09-08T01:43:09.821781
MetadataPublished	2023-10-10

Field	Value
Measurement Technique	heteronuclear multiple bond coherence
Measurement Variables