Dataset

mass spectrometry (MS)

dataset for mass spectrometry (MS)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C34H36O4/c1-21(35)25-5-13-29(14-6-25)33(30-15-7-26(8-16-30)22(2)36)34(31-17-9-27(10-18-31)23(3)37)32-19-11-28(12-20-32)24(4)38/h5-24,35-38H,1-4H3
SMILES CC(c1ccc(cc1)/C(=C(\c1ccc(cc1)C(O)C)/c1ccc(cc1)C(O)C)/c1ccc(cc1)C(O)C)O
InChI Key WYNFDKNFCMLYOM-UHFFFAOYSA-N
Molecular Formula C34H36O4
Exact Mass 508.647 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/WYNFDKNFCMLYOM-UHFFFAOYSA-N/CHMO0000470
License URL
Source https://www.chemotion-repository.net/inchikey/WYNFDKNFCMLYOM-UHFFFAOYSA-N/CHMO0000470
Version
Author Yannick Matt
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T03:37:16.078153
MetadataModified 2024-09-07T18:34:44.630645
MetadataPublished 2020-08-26
Field Value
Measurement Technique mass spectrometry
Measurement Variables