Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C21H27NS/c1-15(22(2)3)20-13-16-5-9-18(20)10-6-17-8-12-19(11-7-16)21(14-17)23-4/h5,8-9,12-15H,6-7,10-11H2,1-4H3
SMILES	CSc1cc2CCc3ccc(CCc1cc2)cc3C(N(C)C)C
InChI Key	VCYXYCZXZKJVTD-UHFFFAOYSA-N
Molecular Formula	C21H27NS
Exact Mass	325.511 g/mol

Data and Resources

• infrared absorption spectroscopy (IR)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/VCYXYCZXZKJVTD-UHFFFAOYSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/VCYXYCZXZKJVTD-UHFFFAOYSA-N/IR
Version
Author	Yu-Chieh Huang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:14:38.212300
MetadataModified	2024-09-07T15:19:11.337634
MetadataPublished	2019-06-27
Related Molecule

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
138453491	PubChem
The data in this table is sourced from UniChem at EBI.