Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C29H30FN3/c1-28(2,3)22-13-7-19(8-14-22)25-31-26(20-9-15-23(16-10-20)29(4,5)6)33-27(32-25)21-11-17-24(30)18-12-21/h7-18H,1-6H3
SMILES	Fc1ccc(cc1)c1nc(nc(n1)c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C
InChI Key	HTKZMQNHDRKIHZ-UHFFFAOYSA-N
Molecular Formula	C29H30FN3
Exact Mass	439.567 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/HTKZMQNHDRKIHZ-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/HTKZMQNHDRKIHZ-UHFFFAOYSA-N/CHMO0000470
Version
Author	Zhen Zhang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T03:52:22.815295
MetadataModified	2024-09-07T18:54:29.607703
MetadataPublished	2020-10-05
Related Molecule

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
154701152	PubChem
The data in this table is sourced from UniChem at EBI.