Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Info

InChI	InChI=1S/C16H21N3O/c20-16(18-10-4-1-5-11-18)9-6-12-19-13-17-14-7-2-3-8-15(14)19/h2-3,7-8,13H,1,4-6,9-12H2
SMILES	O=C(N1CCCCC1)CCCn1cnc2c1cccc2
InChI Key	ROMNOCNWUFQBNP-UHFFFAOYSA-N
Molecular Formula	C16H21N3O
Exact Mass	271.357 g/mol

Data and Resources

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Metadata Information

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Field	Value
DOI	10.14272/ROMNOCNWUFQBNP-UHFFFAOYSA-N/NMR/13C/CHLOROFORM-d/75.1
License URL
Source	https://www.chemotion-repository.net/inchikey/ROMNOCNWUFQBNP-UHFFFAOYSA-N/NMR/13C/CHLOROFORM-d/75.1
Version
Author	Steven Susanto
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T21:16:49.862848
MetadataModified	2024-09-07T13:40:41.143528
MetadataPublished	2014-08-03

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

Data-Source Molecule ID	Data-Source
76853103	PubChem
The data in this table is sourced from UniChem at EBI.