Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C23H20N2O5/c1-28-19-11-9-18(10-12-19)24-25-21-14-17(23(27)30-3)8-13-20(21)15-4-6-16(7-5-15)22(26)29-2/h4-14H,1-3H3/b25-24+
SMILES	COc1ccc(cc1)/N=N/c1cc(ccc1c1ccc(cc1)C(=O)OC)C(=O)OC
InChI Key	PYNSCBTWORIUPC-OCOZRVBESA-N
Molecular Formula	C23H20N2O5
Exact Mass	404.415 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/PYNSCBTWORIUPC-OCOZRVBESA-N/Mass.1
License URL
Source	https://www.chemotion-repository.net/inchikey/PYNSCBTWORIUPC-OCOZRVBESA-N/Mass.1
Version
Author	Sylvain Grosjean
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T00:56:29.310949
MetadataModified	2024-09-07T14:52:30.550977
MetadataPublished	2019-04-03

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.