CID 3157476

875400-96-7

Structural Information

Molecular Formula
C9H20N2
SMILES
CC(C)N1CCCC(C1)CN
InChI
InChI=1S/C9H20N2/c1-8(2)11-5-3-4-9(6-10)7-11/h8-9H,3-7,10H2,1-2H3
InChIKey
FGNRRDAUWGLVRV-UHFFFAOYSA-N
Compound name
(1-propan-2-ylpiperidin-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

32
Patents

156.16264 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.169916 138.9
[M+Na]+ 179.151858 143.0
[M-H]- 155.155364 139.7
[M+NH4]+ 174.196463 158.0
[M+K]+ 195.125798 141.9
[M+H-H2O]+ 139.159900 132.3
[M+HCOO]- 201.160841 157.2
[M+CH3COO]- 215.176491 181.2
[M+Na-2H]- 177.137306 141.3
[M]+ 156.16209142 132.9
[M]- 156.16318858 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