Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C15H17NO3/c1-2-18-15(17)14-7-11-5-6-12(8-13(11)16-14)19-9-10-3-4-10/h5-8,10,16H,2-4,9H2,1H3
SMILES	CCOC(=O)c1cc2c([nH]1)cc(cc2)OCC1CC1
InChI Key	XSKANNIFUURLJU-UHFFFAOYSA-N
Molecular Formula	C15H17NO3
Exact Mass	259.300 g/mol

Data and Resources

• mass spectrometry (MS)HTML
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Metadata Information

• Additional
• Measurement

Field	Value
DOI	10.14272/XSKANNIFUURLJU-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/XSKANNIFUURLJU-UHFFFAOYSA-N/CHMO0000470
Version
Author	Niklas Krappel
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T01:25:31.383090
MetadataModified	2024-09-08T01:25:31.383095
MetadataPublished	2023-07-31

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables