Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C30H24O4/c31-29(32)25-13-9-23(10-14-25)27-17-19-1-5-21(27)8-4-20-2-6-22(7-3-19)28(18-20)24-11-15-26(16-12-24)30(33)34/h1-2,5-6,9-18H,3-4,7-8H2,(H,31,32)(H,33,34)
SMILES	OC(=O)c1ccc(cc1)c1cc2CCc3ccc(CCc1cc2)cc3c1ccc(cc1)C(=O)O
InChI Key	GIWLJIZQPMOWNY-UHFFFAOYSA-N
Molecular Formula	C30H24O4
Exact Mass	448.509 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/GIWLJIZQPMOWNY-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/GIWLJIZQPMOWNY-UHFFFAOYSA-N/CHMO0000470
Version
Author	Yichuan Wang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T08:04:09.366050
MetadataModified	2024-09-07T23:57:43.234657
MetadataPublished	2022-12-07

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
166001336	PubChem
The data in this table is sourced from UniChem at EBI.