Dataset

heteronuclear multiple bond coherence (HMBC)

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

Chemical Info

molecular Image
InChI InChI=1S/C12H17N5O2/c1-3-5-6-9-8-17(16-14-9)11-10(7-13-15-11)12(18)19-4-2/h7-8H,3-6H2,1-2H3,(H,13,15)
SMILES CCCCc1nnn(c1)c1n[nH]cc1C(=O)OCC
InChI Key CDDXWUAJGLDUKH-UHFFFAOYSA-N
Molecular Formula C12H17N5O2
Exact Mass 263.296 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/CDDXWUAJGLDUKH-UHFFFAOYSA-N/CHMO0000601
License URL
Source https://www.chemotion-repository.net/inchikey/CDDXWUAJGLDUKH-UHFFFAOYSA-N/CHMO0000601
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T02:56:51.385325
MetadataModified 2024-09-08T02:56:51.385329
MetadataPublished 2024-02-14
Field Value
Measurement Technique heteronuclear multiple bond coherence
Measurement Variables