CID 55272863

2-methyl-5-(piperidin-2-yl)aniline

Structural Information

Molecular Formula
C12H18N2
SMILES
CC1=C(C=C(C=C1)C2CCCCN2)N
InChI
InChI=1S/C12H18N2/c1-9-5-6-10(8-11(9)13)12-4-2-3-7-14-12/h5-6,8,12,14H,2-4,7,13H2,1H3
InChIKey
MJZWHZFZLUUHGH-UHFFFAOYSA-N
Compound name
2-methyl-5-piperidin-2-ylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

190.147 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.15428 144.5
[M+Na]+ 213.13622 149.7
[M-H]- 189.13972 147.4
[M+NH4]+ 208.18082 161.5
[M+K]+ 229.11016 145.3
[M+H-H2O]+ 173.14426 137.1
[M+HCOO]- 235.14520 162.9
[M+CH3COO]- 249.16085 183.5
[M+Na-2H]- 211.12167 148.2
[M]+ 190.14645 136.4
[M]- 190.14755 136.4
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.