CID 165919823

(6s)-6-ethynyl-5-azaspiro[2.4]heptane hydrochloride

Structural Information

Molecular Formula
C8H11N
SMILES
C#CC1CC2(CC2)CN1
InChI
InChI=1S/C8H11N/c1-2-7-5-8(3-4-8)6-9-7/h1,7,9H,3-6H2
InChIKey
FOZYRTMYBDSODU-UHFFFAOYSA-N
Compound name
6-ethynyl-5-azaspiro[2.4]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

121.08915 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.09643 125.2
[M+Na]+ 144.07837 141.0
[M-H]- 120.08187 129.4
[M+NH4]+ 139.12297 144.2
[M+K]+ 160.05231 133.0
[M+H-H2O]+ 104.08641 116.5
[M+HCOO]- 166.08735 141.7
[M+CH3COO]- 180.10300 138.6
[M+Na-2H]- 142.06382 132.0
[M]+ 121.08860 119.9
[M]- 121.08970 119.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.