Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C11H10Cl2S/c12-8-1-9(13)3-10(2-8)14-11-4-7(5-11)6-11/h1-3,7H,4-6H2
SMILES	Clc1cc(SC23CC(C2)C3)cc(c1)Cl
InChI Key	DCGRYOJVMVWIEU-UHFFFAOYSA-N
Molecular Formula	C11H10Cl2S
Exact Mass	245.168 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/DCGRYOJVMVWIEU-UHFFFAOYSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/DCGRYOJVMVWIEU-UHFFFAOYSA-N/IR
Version
Author	Stefan Bräse
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:31:50.176431
MetadataModified	2024-09-07T15:44:47.131441
MetadataPublished	2019-06-27
Related Molecule

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
138453753	PubChem
The data in this table is sourced from UniChem at EBI.