Specification: |
Descriptors computed from structure, you can know some information about 1,3,5-Hexatriyne (CAS NO.3161-99-7) :
Canonical SMILES: C#CC#CC#C
InChI: InChI=1S/C6H2/c1-3-5-6-4-2/h1-2H
InChIKey: MZHROOGPARRVHS-UHFFFAOYSA-N
Exact Mass: 74.01565
MonoIsotopic Mass: 74.01565
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