Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C11H12N2O/c1-2-9(1)8-14-10-3-5-13-6-4-12-11(13)7-10/h3-7,9H,1-2,8H2
SMILES c1cn2c(n1)cc(cc2)OCC1CC1
InChI Key DMOHTLQCVAPBEE-UHFFFAOYSA-N
Molecular Formula C11H12N2O
Exact Mass 188.226 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/DMOHTLQCVAPBEE-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/DMOHTLQCVAPBEE-UHFFFAOYSA-N/CHMO0000595
Version
Author Niklas Krappel
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T01:15:18.257534
MetadataModified 2024-09-08T01:15:18.257538
MetadataPublished 2023-07-31
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables