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

0
Patents

174.11569 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.12297 145.0
[M+Na]+ 197.10491 153.4
[M-H]- 173.10841 148.6
[M+NH4]+ 192.14951 159.5
[M+K]+ 213.07885 149.6
[M+H-H2O]+ 157.11295 137.1
[M+HCOO]- 219.11389 162.2
[M+CH3COO]- 233.12954 156.1
[M+Na-2H]- 195.09036 153.3
[M]+ 174.11514 142.0
[M]- 174.11624 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.