CID 3860971

1-methylpiperidin-3-amine

Structural Information

Molecular Formula
C6H14N2
SMILES
CN1CCCC(C1)N
InChI
InChI=1S/C6H14N2/c1-8-4-2-3-6(7)5-8/h6H,2-5,7H2,1H3
InChIKey
QZSACHHNFDNCNB-UHFFFAOYSA-N
Compound name
1-methylpiperidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1239
Patents

114.1157 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.122976 124.8
[M+Na]+ 137.104918 130.5
[M-H]- 113.108424 126.1
[M+NH4]+ 132.149523 145.7
[M+K]+ 153.078858 129.6
[M+H-H2O]+ 97.112960 118.8
[M+HCOO]- 159.113901 145.1
[M+CH3COO]- 173.129551 171.1
[M+Na-2H]- 135.090366 130.2
[M]+ 114.11515142 118.5
[M]- 114.11624858 118.5
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