Dataset

electron ionisation mass spectrometry (EI-MS)

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

Chemical Info

molecular Image
InChI InChI=1S/C11H17N5S/c1-8(2)16-7-15-9-10(12-4-5-17-3)13-6-14-11(9)16/h6-8H,4-5H2,1-3H3,(H,12,13,14)
SMILES CSCCNc1ncnc2c1ncn2C(C)C
InChI Key NEHPRVYJYMNUAK-UHFFFAOYSA-N
Molecular Formula C11H17N5S
Exact Mass 251.351 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/NEHPRVYJYMNUAK-UHFFFAOYSA-N/Mass/EI
License URL
Source https://www.chemotion-repository.net/inchikey/NEHPRVYJYMNUAK-UHFFFAOYSA-N/Mass/EI
Version
Author Nicole Jung
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T22:37:26.313703
MetadataModified 2024-09-07T11:58:34.497602
MetadataPublished 2014-05-27
Field Value
Measurement Technique electron ionisation mass spectrometry
Measurement Variables