CID 7258859

[1-(propan-2-yl)piperidin-4-yl]methanamine dihydrochloride

Structural Information

Molecular Formula
C9H20N2
SMILES
CC(C)N1CCC(CC1)CN
InChI
InChI=1S/C9H20N2/c1-8(2)11-5-3-9(7-10)4-6-11/h8-9H,3-7,10H2,1-2H3
InChIKey
IYCMYOWBZQNVBV-UHFFFAOYSA-N
Compound name
(1-propan-2-ylpiperidin-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

208
Patents

156.16264 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.16992 138.9
[M+Na]+ 179.15186 143.0
[M-H]- 155.15536 139.7
[M+NH4]+ 174.19646 158.0
[M+K]+ 195.12580 141.9
[M+H-H2O]+ 139.15990 132.3
[M+HCOO]- 201.16084 157.2
[M+CH3COO]- 215.17649 181.2
[M+Na-2H]- 177.13731 141.3
[M]+ 156.16209 132.9
[M]- 156.16319 132.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe