Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C25H23N3O/c1-29-23-14-12-22(13-15-23)28-25(17-26-27-28)24-16-20-7-6-18-2-4-19(5-3-18)8-10-21(24)11-9-20/h2-5,9,11-17H,6-8,10H2,1H3
SMILES	COc1ccc(cc1)n1nncc1c1cc2CCc3ccc(CCc1cc2)cc3
InChI Key	UIUPXPAOUNCBNR-UHFFFAOYSA-N
Molecular Formula	C25H23N3O
Exact Mass	381.470 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/UIUPXPAOUNCBNR-UHFFFAOYSA-N/Mass
License URL
Source	https://www.chemotion-repository.net/inchikey/UIUPXPAOUNCBNR-UHFFFAOYSA-N/Mass
Version
Author	Simone Gräßle
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T02:07:38.641015
MetadataModified	2024-09-07T16:35:21.591946
MetadataPublished	2020-02-11

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
145915838	PubChem
The data in this table is sourced from UniChem at EBI.