1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

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Dataset

1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

dataset for 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

Chemical Information

molecular Image

InChI	InChI=1S/C7H5FN2/c8-6-2-1-5(4-9)7(10)3-6/h1-3H,10H2
SMILES	N#Cc1ccc(cc1N)F
InChI Key	CBXKVIFVKCNVGJ-UHFFFAOYSA-N
Exact Mass	136.126 g/mol

Data and Resources

1H--13C heteronuclear multiple bond coherence...HTML

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Metadata Information

Field	Value
DOI	10.14272/CBXKVIFVKCNVGJ-UHFFFAOYSA-N/CHMO0001148
License URL
Source	https://www.chemotion-repository.net/inchikey/CBXKVIFVKCNVGJ-UHFFFAOYSA-N/CHMO0001148
Version
Author	Stefan Bräse
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2025-09-12
Related Molecule

Field	Value
Measurement Technique	1H–13C heteronuclear multiple bond coherence
Measurement Variables	date : 2025-09-12 starting time : 00:13:19 UTC creator : Sylvia Vanderheiden-Schroen label : SVS-3996 id : 386659 Solvent : CDCl3 temperature : 297.992461657267 K PULPROG : hmbcgpndqf number of scans : 8 scans instrument : Avance NEO 400 Name : TopSpin

Data-Source Molecule ID	Data-Source
404482	surechembl
9942158	pubchem
Molport-005-943-529	molport
The data in this table is sourced from UniChem at EBI.