Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C24H24N.HI/c1-25-16-14-21(15-17-25)9-13-24-18-22-7-6-19-2-4-20(5-3-19)8-11-23(24)12-10-22;/h2-5,9-10,12-18H,6-8,11H2,1H3;1H/q+1;/p-1/b13-9+;
SMILES	C[n+]1ccc(cc1)/C=C/c1cc2ccc1CCc1ccc(CC2)cc1.[I-]
InChI Key	GRWXNDHDQXREIU-KJEVSKRMSA-M
Molecular Formula	C24H24IN
Exact Mass	453.359 g/mol

Data and Resources

• mass spectrometry (MS)HTML
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• mass-spectrometry

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/GRWXNDHDQXREIU-KJEVSKRMSA-M/CHMO0000470.1
License URL
Source	https://www.chemotion-repository.net/inchikey/GRWXNDHDQXREIU-KJEVSKRMSA-M/CHMO0000470.1
Version
Author	Yichuan Wang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T04:11:27.219927
MetadataModified	2024-09-08T04:11:27.219932
MetadataPublished	2024-07-10

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
155908649	PubChem
The data in this table is sourced from UniChem at EBI.