Dataset

electron ionisation mass spectrometry (EI-MS)

dataset for electron ionisation mass spectrometry (EI-MS)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C22H20Br2/c1-13-11-21(23)15(3)9-19(13)17-5-7-18(8-6-17)20-10-16(4)22(24)12-14(20)2/h5-12H,1-4H3
SMILES Cc1cc(Br)c(cc1c1ccc(cc1)c1cc(C)c(cc1C)Br)C
InChI Key BVWZNESRMMDVAS-UHFFFAOYSA-N
Molecular Formula C22H20Br2
Exact Mass 444.202 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BVWZNESRMMDVAS-UHFFFAOYSA-N/Mass/EI
License URL
Source https://www.chemotion-repository.net/inchikey/BVWZNESRMMDVAS-UHFFFAOYSA-N/Mass/EI
Version
Author Sylvain Grosjean
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T22:50:54.072097
MetadataModified 2024-09-07T12:08:01.309171
MetadataPublished 2014-05-27
Field Value
Measurement Technique electron ionisation mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
73427290 PubChem
The data in this table is sourced from UniChem at EBI.