Dataset

high-resolution mass spectrometry (HRMS)

Chemical Info

InChI	InChI=1S/C16H10O4/c1-2-10-9-13(16(19)20)7-8-14(10)11-3-5-12(6-4-11)15(17)18/h1,3-9H,(H,17,18)(H,19,20)
SMILES	C#Cc1cc(ccc1c1ccc(cc1)C(=O)O)C(=O)O
InChI Key	KWICUFUMJGNKKB-UHFFFAOYSA-N
Molecular Formula	C16H10O4
Exact Mass	266.248 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/KWICUFUMJGNKKB-UHFFFAOYSA-N/CHMO0000498
License URL
Source	https://www.chemotion-repository.net/inchikey/KWICUFUMJGNKKB-UHFFFAOYSA-N/CHMO0000498
Version
Author	Sylvain Grosjean
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T03:29:56.135183
MetadataModified	2024-09-07T18:24:58.722556
MetadataPublished	2020-08-06

Field	Value
Measurement Technique	high-resolution mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
J3.476.173F	Nikkaji
122367260	PubChem
The data in this table is sourced from UniChem at EBI.