Dataset

heteronuclear single quantum coherence (HSQC)

dataset for heteronuclear single quantum coherence (HSQC)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C17H22N6/c1-13(2)23(14(3)4)21-20-17-16(10-18)11-19-22(17)12-15-8-6-5-7-9-15/h5-9,11,13-14H,12H2,1-4H3/b21-20+
SMILES CC(N(C(C)C)/N=N/c1n(ncc1C#N)Cc1ccccc1)C
InChI Key AQYSAXXLCHFEGV-QZQOTICOSA-N
Molecular Formula C17H22N6
Exact Mass 310.397 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/AQYSAXXLCHFEGV-QZQOTICOSA-N/CHMO0000604
License URL
Source https://www.chemotion-repository.net/inchikey/AQYSAXXLCHFEGV-QZQOTICOSA-N/CHMO0000604
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T02:31:56.999550
MetadataModified 2024-09-08T02:31:56.999556
MetadataPublished 2024-02-14
Field Value
Measurement Technique heteronuclear single quantum coherence
Measurement Variables
Data-Source Molecule ID Data-Source
155928578 PubChem
The data in this table is sourced from UniChem at EBI.