Dataset

process

Chemical Info

InChI	InChI=1S/2C14H22N4.2CHF3O3S.Zn/c2*1-17(2)14(18(3)4)16-12-9-5-7-11-8-6-10-15-13(11)12;2*2-1(3,4)8(5,6)7;/h2*6,8,10,12H,5,7,9H2,1-4H3;2*(H,5,6,7);/q;;;;+2/p-2
SMILES	FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.CN(C(=NC1CCCc2c1nccc2)N(C)C)C.CN(C(=NC1CCCc2c1nccc2)N(C)C)C.[Zn+2]
InChI Key	LGSDFUJUBGCHIW-UHFFFAOYSA-L
Molecular Formula	C30H44F6N8O6S2Zn
Exact Mass	856.221 g/mol

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/LGSDFUJUBGCHIW-UHFFFAOYSA-L/BFO0000015
License URL
Source	https://www.chemotion-repository.net/inchikey/LGSDFUJUBGCHIW-UHFFFAOYSA-L/BFO0000015
Version
Author	Sonja Herres-Pawlis
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T06:56:09.252990
MetadataModified	2024-09-07T22:27:54.992869
MetadataPublished	2022-07-14

Field	Value
Measurement Technique	process
Measurement Variables

Data-Source Molecule ID	Data-Source
164510638	PubChem
The data in this table is sourced from UniChem at EBI.