Dataset

electron ionisation mass spectrometry (EI-MS)

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

Chemical Info

molecular Image
InChI InChI=1S/C33H29N/c1-22-18-23(2)29-21-31(27-6-4-3-5-7-27)33(34-32(29)19-22)30-20-26-13-12-24-8-10-25(11-9-24)14-16-28(30)17-15-26/h3-11,15,17-21H,12-14,16H2,1-2H3
SMILES Cc1cc(C)c2c(c1)nc(c(c2)c1ccccc1)c1cc2CCc3ccc(CCc1cc2)cc3
InChI Key HCKHACPXJZQVRJ-UHFFFAOYSA-N
Molecular Formula C33H29N
Exact Mass 439.590 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HCKHACPXJZQVRJ-UHFFFAOYSA-N/CHMO0000480
License URL
Source https://www.chemotion-repository.net/inchikey/HCKHACPXJZQVRJ-UHFFFAOYSA-N/CHMO0000480
Version
Author Tilman Hans Köhler
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T03:47:53.622007
MetadataModified 2024-09-08T03:47:53.622012
MetadataPublished 2024-05-21
Field Value
Measurement Technique electron ionisation mass spectrometry
Measurement Variables