Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C15H13NOS/c1-10-3-8-13-14(9-10)18-15(16-13)11-4-6-12(17-2)7-5-11/h3-9H,1-2H3
SMILES COc1ccc(cc1)c1nc2c(s1)cc(cc2)C
InChI Key AWYKSNJSUDJLBZ-UHFFFAOYSA-N
Molecular Formula C15H13NOS
Exact Mass 255.335 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/AWYKSNJSUDJLBZ-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/AWYKSNJSUDJLBZ-UHFFFAOYSA-N/CHMO0000593
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T02:34:46.846635
MetadataModified 2024-09-07T17:10:06.022505
MetadataPublished 2020-02-28
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables