Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C10H13NO/c1-8(2)11-10-5-3-9(7-12)4-6-10/h3-8,11H,1-2H3
SMILES	O=Cc1ccc(cc1)NC(C)C
InChI Key	FMWJFHMFGDMYAB-UHFFFAOYSA-N
Molecular Formula	C10H13NO
Exact Mass	163.216 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/FMWJFHMFGDMYAB-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/FMWJFHMFGDMYAB-UHFFFAOYSA-N/CHMO0000470
Version
Author	Simone Gräßle
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T02:28:23.804724
MetadataModified	2024-09-07T17:01:20.316223
MetadataPublished	2020-02-28

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
SCHEMBL4901085	SureChEMBL
20190720	PubChem
The data in this table is sourced from UniChem at EBI.