Dataset

high-resolution electrospray ionisation mass spectrometry (HRESIMS)

dataset for high-resolution electrospray ionisation mass spectrometry (HRESIMS)

Chemical Information

molecular Image
InChI InChI=1S/C18H15ClO/c1-12-15(10-11-18(12)20)17-5-3-2-4-16(17)13-6-8-14(19)9-7-13/h2-9H,10-11H2,1H3
SMILES Clc1ccc(cc1)c1ccccc1C1=C(C)C(=O)CC1
InChI Key DWXCSXVJDPVMPS-UHFFFAOYSA-N
Exact Mass 282.764 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/DWXCSXVJDPVMPS-UHFFFAOYSA-N/CHMO0000485
License URL
Source https://www.chemotion-repository.net/inchikey/DWXCSXVJDPVMPS-UHFFFAOYSA-N/CHMO0000485
Version
Author Thorsten Bach
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-11-24
Related Molecule
  • nfdi4chem-mol1257 (Unknown Molecule)
    • Field Value
    Measurement Technique high-resolution electrospray ionisation mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.