Dataset

electrospray ionisation quadrupole detection (ESI Q Trap)

dataset for electrospray ionisation quadrupole detection (ESI Q Trap)

Chemical Information

molecular Image
InChI InChI=1S/C17H28O2/c1-12-7-9-13(10-8-12)16(5)11-17(16,6)14(18)19-15(2,3)4/h7,13H,8-11H2,1-6H3/t13-,16?,17?/m1/s1
SMILES CC1=CC[C@H](CC1)C1(C)CC1(C)C(=O)OC(C)(C)C
InChI Key ZJPOTYKHDDHGED-NVPAJSRCSA-N
Molecular Formula C17H28O2
Exact Mass 264.403 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ZJPOTYKHDDHGED-NVPAJSRCSA-N/CHMO0002337
License URL
Source https://www.chemotion-repository.net/inchikey/ZJPOTYKHDDHGED-NVPAJSRCSA-N/CHMO0002337
Version
Author Christoph Zippel
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-10-02
Related Molecule
  • tert-butyl 1,2-dimethyl-2-[(1S)-4-methylcyclohex-3-en-1-yl]cyclopropane-1-carboxylate
    • Field Value
    Measurement Technique electrospray ionisation quadrupole detection
    Measurement Variables
    Data-Source Molecule ID Data-Source
    154701150 pubchem
    The data in this table is sourced from UniChem at EBI.