Dataset

process

dataset for process\n\n

Chemical Info

molecular Image
InChI InChI=1S/C26H23ClO4/c27-24(16-31-26(30)22-4-2-1-3-21(22)25(28)29)23-15-19-10-9-17-5-7-18(8-6-17)11-13-20(23)14-12-19/h1-8,12,14-15,24H,9-11,13,16H2,(H,28,29)
SMILES ClC(c1cc2CCc3ccc(CCc1cc2)cc3)COC(=O)c1ccccc1C(=O)O
InChI Key RQJMVWFPHPJEEO-UHFFFAOYSA-N
Exact Mass 434.911 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/RQJMVWFPHPJEEO-UHFFFAOYSA-N/BFO0000015
License URL
Source https://www.chemotion-repository.net/inchikey/RQJMVWFPHPJEEO-UHFFFAOYSA-N/BFO0000015
Version
Author Patrick Kern
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T03:50:28.665907
MetadataModified 2024-09-23T09:25:12.786841
MetadataPublished 2024-06-05
Field Value
Measurement Technique process
Measurement Variables
temperature : 298.0 K

PULPROG : zg30

number of scans : 16 scans

title : Dec22-2022

date : 20221222

starting time : 13.28 h

instrument : Avance NEO

label : PAK-720

id : 255250

Solvent : chloroform-D1 (CDCl3)

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