Dataset

electrospray ionisation mass spectrometry (ESMS)

Chemical Info

InChI	InChI=1S/C18H22O2/c1-20-18(13-3-2-4-16(19)10-13)17-14-6-11-5-12(8-14)9-15(17)7-11/h2-4,10-12,14-15,19H,5-9H2,1H3/b18-17-
SMILES	CO/C(=C/1\C2CC3CC1CC(C2)C3)/c1cccc(c1)O
InChI Key	UOQZATKCYBGHSE-ZCXUNETKSA-N
Molecular Formula	C18H22O2
Exact Mass	270.366 g/mol

Data and Resources

• electrospray ionisation mass spectrometry (ESMS)HTML
  Explore

  • More information
  • Go to resource

• electrospray-ionisa...

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/UOQZATKCYBGHSE-ZCXUNETKSA-N/CHMO0000482
License URL
Source	https://www.chemotion-repository.net/inchikey/UOQZATKCYBGHSE-ZCXUNETKSA-N/CHMO0000482
Version
Author	Nilima Manoj Kumar
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T06:42:51.782598
MetadataModified	2024-09-07T22:17:18.307145
MetadataPublished	2022-04-19

Field	Value
Measurement Technique	electrospray ionisation mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
SCHEMBL734321	SureChEMBL
The data in this table is sourced from UniChem at EBI.