CID 58902776

3-methylidene-8-azabicyclo[3.2.1]octane hydrochloride

Structural Information

Molecular Formula
C8H13N
SMILES
C=C1CC2CCC(C1)N2
InChI
InChI=1S/C8H13N/c1-6-4-7-2-3-8(5-6)9-7/h7-9H,1-5H2
InChIKey
MXQPENUGELTBFF-UHFFFAOYSA-N
Compound name
3-methylidene-8-azabicyclo[3.2.1]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

123.1048 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.112076 126.9
[M+Na]+ 146.094018 133.2
[M-H]- 122.097524 126.5
[M+NH4]+ 141.138623 150.6
[M+K]+ 162.067958 130.2
[M+H-H2O]+ 106.102060 121.8
[M+HCOO]- 168.103001 143.8
[M+CH3COO]- 182.118651 139.4
[M+Na-2H]- 144.079466 132.0
[M]+ 123.10425142 120.4
[M]- 123.10534858 120.4
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

patents stripe