Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C18H17NO/c1-2-4-14(5-3-1)17-10-15-8-9-16(11-18(15)19-17)20-12-13-6-7-13/h1-5,8-11,13,19H,6-7,12H2
SMILES	c1ccc(cc1)c1cc2c([nH]1)cc(cc2)OCC1CC1
InChI Key	VTDFXMRBMKTVOK-UHFFFAOYSA-N
Molecular Formula	C18H17NO
Exact Mass	263.334 g/mol

Data and Resources

• mass spectrometry (MS)HTML
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Metadata Information

• Additional
• Measurement

Field	Value
DOI	10.14272/VTDFXMRBMKTVOK-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/VTDFXMRBMKTVOK-UHFFFAOYSA-N/CHMO0000470
Version
Author	Niklas Krappel
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T01:19:10.617647
MetadataModified	2024-09-08T01:19:10.617653
MetadataPublished	2023-07-31

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables