Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C36H24BNO2/c1-3-11-27(12-4-1)38(28-13-5-2-6-14-28)29-21-19-25(20-22-29)26-23-32-30-15-7-9-17-34(30)39-37-36(32)33(24-26)31-16-8-10-18-35(31)40-37/h1-24H
SMILES	c1ccc(cc1)N(c1ccccc1)c1ccc(cc1)c1cc2c3ccccc3ob3c2c(c1)c1ccccc1o3
InChI Key	MTWZKVCZBWMWJP-UHFFFAOYSA-N
Molecular Formula	C36H24BNO2
Exact Mass	513.392 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/MTWZKVCZBWMWJP-UHFFFAOYSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/MTWZKVCZBWMWJP-UHFFFAOYSA-N/IR
Version
Author	Stefan Bräse
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:31:47.111011
MetadataModified	2024-09-07T15:44:43.478699
MetadataPublished	2019-06-27
Related Molecule

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
138453752	PubChem
The data in this table is sourced from UniChem at EBI.