infrared absorption spectroscopy (IR)

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The Chemotion Repository contains various analytical data of molecules like NMR, MS, IR or UV Spectra. Chemotion (as of May 2022) contains 9719 analytical datasets (3930 NMR,...

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Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)\n\n

Chemical Info

InChI	InChI=1S/C6H3Br2NO/c7-4-1-2-5(8)6(3-4)9-10/h1-3H
SMILES	O=Nc1cc(Br)ccc1Br
InChI Key	QXUQRRROWMYWMP-UHFFFAOYSA-N
Molecular Formula	C6H3Br2NO
Exact Mass	264.902 g/mol

Data and Resources

infrared absorption spectroscopy (IR)HTML
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Metadata Information

Field	Value
DOI	10.14272/QXUQRRROWMYWMP-UHFFFAOYSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/QXUQRRROWMYWMP-UHFFFAOYSA-N/IR
Version
Author	Patrick Hodapp
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T00:58:52.694769
MetadataModified	2024-09-07T14:55:49.364891
MetadataPublished	2019-04-06
Related Molecule

Data-Source Molecule ID	Data-Source
87551951	PubChem
SCHEMBL3650552	SureChEMBL
The data in this table is sourced from UniChem at EBI.

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables