Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Info

InChI	InChI=1S/C12H17N/c1-10-5-7-11(8-6-10)9-13-12(2,3)4/h5-9H,1-4H3/b13-9+
SMILES	Cc1ccc(cc1)/C=N/C(C)(C)C
InChI Key	REJFNMQVXPWSOL-UKTHLTGXSA-N
Molecular Formula	C12H17N
Exact Mass	175.270 g/mol

Data and Resources

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Metadata Information

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• Molecule Data-Sources

Field	Value
DOI	10.14272/REJFNMQVXPWSOL-UKTHLTGXSA-N/NMR/13C/C6D6/100.1
License URL
Source	https://www.chemotion-repository.net/inchikey/REJFNMQVXPWSOL-UKTHLTGXSA-N/NMR/13C/C6D6/100.1
Version
Author	Sebastian Tussing
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T21:25:25.878730
MetadataModified	2024-09-07T13:53:59.054125
MetadataPublished	2014-09-25

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
16496179	PubChem: Thomson Pharma
J1.188.293E	Nikkaji
The data in this table is sourced from UniChem at EBI.