Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C23H21NO/c1-2-3-14-24-16-21(20-10-6-7-11-22(20)24)23(25)19-13-12-17-8-4-5-9-18(17)15-19/h4-13,15-16H,2-3,14H2,1H3
SMILES	CCCCn1cc(c2c1cccc2)C(=O)c1ccc2c(c1)cccc2
InChI Key	LCZKNUDVFMMPPZ-UHFFFAOYSA-N
Molecular Formula	C23H21NO
Exact Mass	327.419 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/LCZKNUDVFMMPPZ-UHFFFAOYSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/LCZKNUDVFMMPPZ-UHFFFAOYSA-N/IR
Version
Author	Yu-Chieh Huang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:22:09.994311
MetadataModified	2024-09-07T15:30:16.977106
MetadataPublished	2019-06-27

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
PD019527	ProbesDrugs
91733029	PubChem
ZINC000064859630	ZINC
36725581	eMolecules
The data in this table is sourced from UniChem at EBI.