Dataset
electron ionisation mass spectrometry (EI-MS)
Chemical Info
InChI | InChI=1S/C12H17N/c1-10-5-7-11(8-6-10)9-13-12(2,3)4/h5-9H,1-4H3/b13-9+ |
---|---|
SMILES | Cc1ccc(cc1)/C=N/C(C)(C)C |
InChI Key | REJFNMQVXPWSOL-UKTHLTGXSA-N |
Molecular Formula | C12H17N |
Exact Mass | 175.270 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/REJFNMQVXPWSOL-UKTHLTGXSA-N/Mass/EI.1 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/REJFNMQVXPWSOL-UKTHLTGXSA-N/Mass/EI.1 |
Version | |
Author | Sebastian Tussing |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-06T21:25:37.283966 |
MetadataModified | 2024-09-07T13:53:51.816492 |
MetadataPublished | 2014-09-25 |
Related Molecule |
Field | Value |
---|---|
Measurement Technique | electron ionisation mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
16496179 | PubChem: Thomson Pharma |
J1.188.293E | Nikkaji |
The data in this table is sourced from UniChem at EBI. |