Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C11H11ClS/c12-9-2-1-3-10(4-9)13-11-5-8(6-11)7-11/h1-4,8H,5-7H2
SMILES	Clc1cccc(c1)SC12CC(C1)C2
InChI Key	IHCQZQPPNCXKRM-UHFFFAOYSA-N
Molecular Formula	C11H11ClS
Exact Mass	210.723 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement

Field	Value
DOI	10.14272/IHCQZQPPNCXKRM-UHFFFAOYSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/IHCQZQPPNCXKRM-UHFFFAOYSA-N/IR
Version
Author	Stefan Bräse
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:20:09.839547
MetadataModified	2024-09-07T15:27:19.962089
MetadataPublished	2019-06-27

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables