Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C17H18N2O/c18-19-17(20)16-11-14-6-5-12-1-3-13(4-2-12)7-9-15(16)10-8-14/h1-4,8,10-11H,5-7,9,18H2,(H,19,20)
SMILES	NNC(=O)c1cc2CCc3ccc(CCc1cc2)cc3
InChI Key	MYCCCDACIQEGNH-UHFFFAOYSA-N
Molecular Formula	C17H18N2O
Exact Mass	266.338 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/MYCCCDACIQEGNH-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/MYCCCDACIQEGNH-UHFFFAOYSA-N/CHMO0000470
Version
Author	Lamiaa Abdelhaleem
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T04:38:40.652842
MetadataModified	2024-09-08T04:38:40.652846
MetadataPublished	2024-09-01

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
165111954	PubChem
The data in this table is sourced from UniChem at EBI.