Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C32H32N2.2HI/c1-33-19-15-25(16-20-33)3-13-31-23-27-5-9-29(31)11-7-28-6-10-30(12-8-27)32(24-28)14-4-26-17-21-34(2)22-18-26;;/h3-6,9-10,13-24H,7-8,11-12H2,1-2H3;2*1H/q+2;;/p-2/b13-3+,14-4+;;
SMILES	C[n+]1ccc(cc1)/C=C/c1cc2CCc3ccc(CCc1cc2)cc3/C=C/c1cc[n+](cc1)C.[I-].[I-]
InChI Key	VELYGFXWBWMOFZ-FKVJNPCXSA-L
Molecular Formula	C32H32I2N2
Exact Mass	698.419 g/mol

Data and Resources

• mass spectrometry (MS)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/VELYGFXWBWMOFZ-FKVJNPCXSA-L/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/VELYGFXWBWMOFZ-FKVJNPCXSA-L/CHMO0000470
Version
Author	Yichuan Wang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T04:07:31.590758
MetadataModified	2024-09-08T04:07:31.590763
MetadataPublished	2024-07-10

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

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