CID 9859458

Akos040805778

Structural Information

Molecular Formula
C13H20N4
SMILES
C1CN(CCC1N=C(N)N)CC2=CC=CC=C2
InChI
InChI=1S/C13H20N4/c14-13(15)16-12-6-8-17(9-7-12)10-11-4-2-1-3-5-11/h1-5,12H,6-10H2,(H4,14,15,16)
InChIKey
MSZVBZJWLZLDBM-UHFFFAOYSA-N
Compound name
2-(1-benzylpiperidin-4-yl)guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

232.1688 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.17608 155.5
[M+Na]+ 255.15802 164.8
[M+NH4]+ 250.20262 163.3
[M+K]+ 271.13196 158.4
[M-H]- 231.16152 160.6
[M+Na-2H]- 253.14347 162.3
[M]+ 232.16825 157.8
[M]- 232.16935 157.8
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