CID 21132352

1-n-(1-methylpiperidin-4-yl)benzene-1,2-diamine

Structural Information

Molecular Formula
C12H19N3
SMILES
CN1CCC(CC1)NC2=CC=CC=C2N
InChI
InChI=1S/C12H19N3/c1-15-8-6-10(7-9-15)14-12-5-3-2-4-11(12)13/h2-5,10,14H,6-9,13H2,1H3
InChIKey
ZXONFSGVQZHXDB-UHFFFAOYSA-N
Compound name
2-N-(1-methylpiperidin-4-yl)benzene-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

15
Patents

205.1579 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.16518 148.1
[M+Na]+ 228.14712 159.4
[M+NH4]+ 223.19172 156.9
[M+K]+ 244.12106 152.3
[M-H]- 204.15062 153.3
[M+Na-2H]- 226.13257 155.6
[M]+ 205.15735 151.0
[M]- 205.15845 151.0
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

patents stripe