Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C12H15NO2/c1-9-8-13-12-7-10(3-4-11(9)12)15-6-5-14-2/h3-4,7-8,13H,5-6H2,1-2H3
SMILES	COCCOc1ccc2c(c1)[nH]cc2C
InChI Key	QKMXDPUMHVPEKS-UHFFFAOYSA-N
Molecular Formula	C12H15NO2
Exact Mass	205.253 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/QKMXDPUMHVPEKS-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/QKMXDPUMHVPEKS-UHFFFAOYSA-N/CHMO0000470
Version
Author	Niklas Krappel
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T01:14:38.324761
MetadataModified	2024-09-08T01:14:38.324766
MetadataPublished	2023-07-31

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.