Dataset

attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)

Chemical Info

InChI	InChI=1S/C20H28N4/c1-23(2)20(24(3)4)22-18-12-8-11-16-13-14-17(21-19(16)18)15-9-6-5-7-10-15/h8,11-15H,5-7,9-10H2,1-4H3
SMILES	CN(C(=Nc1cccc2c1nc(cc2)C1CCCCC1)N(C)C)C
InChI Key	ACOFZHHYLNXZFV-UHFFFAOYSA-N
Molecular Formula	C20H28N4
Exact Mass	324.463 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/ACOFZHHYLNXZFV-UHFFFAOYSA-N/CHMO0000763
License URL
Source	https://www.chemotion-repository.net/inchikey/ACOFZHHYLNXZFV-UHFFFAOYSA-N/CHMO0000763
Version
Author	Alexander Hoffmann
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T06:13:33.110363
MetadataModified	2024-09-07T21:53:47.538124
MetadataPublished	2022-02-18

Field	Value
Measurement Technique	attenuated total reflectance Fourier transform infrared spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
162624766	PubChem
The data in this table is sourced from UniChem at EBI.