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/C14H15N/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h1-10,15H,11-12H2
SMILES N(Cc1ccccc1)Cc1ccccc1
InChI Key BWLUMTFWVZZZND-UHFFFAOYSA-N
Molecular Formula C14H15N
Exact Mass 197.276 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BWLUMTFWVZZZND-UHFFFAOYSA-N/NMR/1H/CDCl3/500.1
License URL
Source https://www.chemotion-repository.net/inchikey/BWLUMTFWVZZZND-UHFFFAOYSA-N/NMR/1H/CDCl3/500.1
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T22:19:35.055237
MetadataModified 2024-09-07T14:13:36.794235
MetadataPublished 2016-04-26
Related Molecule
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
7656 PubChem
MCULE-8716946307 Mcule
ZINC000001504123 ZINC
44037 Brenda
CHEMBL3182419 ChEMBL
HMDB0251169 Human Metabolome Database
GOFKIV CCDC
J37.741D Nikkaji
DTXSID6044355 EPA CompTox Dashboard
93170 Brenda
CB5185977 ChemicalBook
498877 eMolecules
189125 ChEBI
15322393 PubChem: Thomson Pharma
3G0YFX01C6 FDA SRS
103-49-1 ACToR
10005795 NMRShiftDB
SCHEMBL1654 SureChEMBL
The data in this table is sourced from UniChem at EBI.