CID 155970636

2162060-60-6

Structural Information

Molecular Formula
C11H16N2O
SMILES
COC1CC(C1)C(C2=CN=CC=C2)N
InChI
InChI=1S/C11H16N2O/c1-14-10-5-9(6-10)11(12)8-3-2-4-13-7-8/h2-4,7,9-11H,5-6,12H2,1H3
InChIKey
JDQZHKAOTVMZFV-UHFFFAOYSA-N
Compound name
(3-methoxycyclobutyl)-pyridin-3-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.12627 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.133546 143.0
[M+Na]+ 215.115488 147.6
[M-H]- 191.118994 147.3
[M+NH4]+ 210.160093 154.0
[M+K]+ 231.089428 148.9
[M+H-H2O]+ 175.123530 129.9
[M+HCOO]- 237.124471 163.3
[M+CH3COO]- 251.140121 189.5
[M+Na-2H]- 213.100936 147.0
[M]+ 192.12572142 149.2
[M]- 192.12681858 149.2
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.