Dataset

ps.nie7272.CBT1886_F7_F8_p1.230218_cmp1_manus[5]

Chemical Information

InChI	InChI=1S/C9H4Br2N2/c10-6-1-7-5(3-12)4-13-9(7)8(11)2-6/h1-2,4,13H
SMILES	N#CC1=CNC2=C(Br)C=C(Br)C=C12
InChI Key	IVEGXYGMXKFJDG-UHFFFAOYSA-N

Data and Resources

• ps.nie7272.CBT1886_F7_F8_p1.230218_cmp1_manus[5]HTML
  Go to source

• heteronuclear-singl...

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.57992/nmrxiv.p91.s824.d4078
License URL	https://creativecommons.org/licenses/by-sa/4.0/legalcode
Source	https://nmrxiv.org/D4078
Version
Author
Maintainer
Language	english
MetadataPublished	2025-02-06T13:54:45.000000Z
Related Molecule

Field	Value
Measurement Technique	heteronuclear single quantum coherence
Measurement Variables	NMR solvent : DMSO acquisition nucleus : ['1H', '13C'] NMR spectrum by dimensionality : 2 NMR probe : Z75812_0039 (CP TCI 600S3 H-C/N-D-05 Z) Temperature : 299.9982 K magnetic field strength : 14.09618467069695 Tesla number of scans : 32 scans nuclear magnetic resonance pulse sequence : MFhsqceadipf2 Spectral Width : [16.6615571224824, 39.9116521319896] number of data points : 2 points relaxation time measurement : 1.3 seconds

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