https://scidata.unf.edu/facet/00013396
generated at: 2022-12-13 15:38:47.041891
version: 2

SciData JSON-LD chemical twin file for N-butyl-N,N,N-tris(2-hydroxyethyl)ammonium bis(trifluoromethanesulfonyl)amide
type: scidataFramework
uid: chalklab_chemtwin_GPNNGUZTYCUTFG-UHFFFAOYSA-N
authors: 1
description: Metadata, identifiers, descriptors and molecular graph about a chemical substance
publisher: Chalk Research Laboratory, University of North Florida
version: 1.1
keywords: chemical twin
keywords: digital twin
keywords: chemical substance
permalink: https://scidata.unf.edu/tranche/chalklab/chemtwin/GPNNGUZTYCUTFG-UHFFFAOYSA-N.jsonld
toc: sdo:scientificData
toc: sdo:system
toc: sdo:compound
toc: dc:source
toc: dc:rights
ids: obo:IAO_0000578
ids: ss:CHEMINF_000123
ids: ss:CHEMINF_000022
ids: obo:NCIT_C1940
ids: obo:CHEBI_25555
ids: ss:SIO_011118
scidata: scidata
sources: Chalk Research Group - SciData JSON-LD
rights: 1

1
type: author
name: Stuart Chalk
orcid: 0000-0002-0703-7776

scidata
type: scientificData
discipline: w3i:Chemistry
system: system

1
type: substance
name: N-butyl-N,N,N-tris(2-hydroxyethyl)ammonium bis(trifluoromethanesulfonyl)amide
formula: C12H24F6N2O7S2
molweight: 486.5
monoisotopicmass: 0.0
identifiers: identifier
descriptors: descriptor
molgraph: molgraph

identifier
type: IAO_0000578
inchi: InChI=1S/C10H24NO3.C2F6NO4S2/c1-2-3-4-11(5-8-12,6-9-13)7-10-14;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h12-14H,2-10H2,1H3;/q+1;-1
inchikey: GPNNGUZTYCUTFG-UHFFFAOYSA-N

Chalk Research Group - SciData JSON-LD
type: source
url: https://scidata.unf.edu

1
type: rights
holder: Chalk Research Group - University of North Florida
license: https://creativecommons.org/licenses/by-nc/4.0/