Dataset

heteronuclear multiple bond coherence (HMBC)

dataset for heteronuclear multiple bond coherence (HMBC)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C20H26N6O2/c1-6-28-20(27)18-12-22-25(13-17-9-7-8-16(10-17)11-21)19(18)23-24-26(14(2)3)15(4)5/h7-10,12,14-15H,6,13H2,1-5H3/b24-23+
SMILES CCOC(=O)c1cnn(c1/N=N/N(C(C)C)C(C)C)Cc1cccc(c1)C#N
InChI Key WTPBPRNMORPMPY-WCWDXBQESA-N
Molecular Formula C20H26N6O2
Exact Mass 382.459 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/WTPBPRNMORPMPY-WCWDXBQESA-N/CHMO0000601
License URL
Source https://www.chemotion-repository.net/inchikey/WTPBPRNMORPMPY-WCWDXBQESA-N/CHMO0000601
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T02:41:11.128718
MetadataModified 2024-09-08T02:41:11.128725
MetadataPublished 2024-02-14
Field Value
Measurement Technique heteronuclear multiple bond coherence
Measurement Variables