Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C21H27BrN4O/c1-15(2)26(16(3)4)25-24-20-11-10-19(22)13-18(20)14-23-21(27)12-17-8-6-5-7-9-17/h5-11,13,15-16H,12,14H2,1-4H3,(H,23,27)/b25-24+
SMILES	CC(N(C(C)C)/N=N/c1ccc(cc1CNC(=O)Cc1ccccc1)Br)C
InChI Key	MPGODWJCSLSUHD-OCOZRVBESA-N
Molecular Formula	C21H27BrN4O
Exact Mass	431.369 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/MPGODWJCSLSUHD-OCOZRVBESA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/MPGODWJCSLSUHD-OCOZRVBESA-N/IR
Version
Author	Yu-Chieh Huang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:29:48.486674
MetadataModified	2024-09-07T15:41:45.268883
MetadataPublished	2019-06-27
Related Molecule

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.