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/C15H21NOS/c1-14(2,3)12-4-6-13(7-5-12)18(16,17)15-8-11(9-15)10-15/h4-7,11,16H,8-10H2,1-3H3
SMILES CC(c1ccc(cc1)S(=O)(=N)C12CC(C1)C2)(C)C
InChI Key SHJRUIRDOASXQU-UHFFFAOYSA-N
Molecular Formula C15H21NOS
Exact Mass 263.398 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/SHJRUIRDOASXQU-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/SHJRUIRDOASXQU-UHFFFAOYSA-N/CHMO0000593
Version
Author Martin Nieger
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T02:20:01.192315
MetadataModified 2024-09-07T16:50:44.421374
MetadataPublished 2020-02-17
Related Molecule
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
145926382 PubChem
The data in this table is sourced from UniChem at EBI.