Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C11H10O2/c1-7-3-4-8(2)11-9(7)5-6-10(12)13-11/h3-6H,1-2H3
SMILES	O=c1ccc2c(o1)c(C)ccc2C
InChI Key	XUKPCDIFIUREIQ-UHFFFAOYSA-N
Molecular Formula	C11H10O2
Exact Mass	174.196 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/XUKPCDIFIUREIQ-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/XUKPCDIFIUREIQ-UHFFFAOYSA-N/CHMO0000470
Version
Author	Florian Mohr
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T04:18:26.625194
MetadataModified	2024-09-07T19:28:07.400557
MetadataPublished	2021-03-01
Related Molecule

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
15453391	PubChem
J1.118.325E	Nikkaji
SCHEMBL8750126	SureChEMBL
The data in this table is sourced from UniChem at EBI.