CID 146155860

2416237-55-1

Structural Information

Molecular Formula
C11H14N2
SMILES
C1CNCC2C1(C2)C3=CN=CC=C3
InChI
InChI=1S/C11H14N2/c1-2-9(7-12-4-1)11-3-5-13-8-10(11)6-11/h1-2,4,7,10,13H,3,5-6,8H2
InChIKey
UESQVLMSRRRBQA-UHFFFAOYSA-N
Compound name
6-pyridin-3-yl-3-azabicyclo[4.1.0]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

174.11569 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.122966 145.0
[M+Na]+ 197.104908 153.4
[M-H]- 173.108414 148.6
[M+NH4]+ 192.149513 159.5
[M+K]+ 213.078848 149.6
[M+H-H2O]+ 157.112950 137.1
[M+HCOO]- 219.113891 162.2
[M+CH3COO]- 233.129541 156.1
[M+Na-2H]- 195.090356 153.3
[M]+ 174.11514142 142.0
[M]- 174.11623858 142.0
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.