CID 12174992

1-amino-3-(piperidin-1-yl)propan-2-ol

Structural Information

Molecular Formula
C8H18N2O
SMILES
C1CCN(CC1)CC(CN)O
InChI
InChI=1S/C8H18N2O/c9-6-8(11)7-10-4-2-1-3-5-10/h8,11H,1-7,9H2
InChIKey
VOQTZJYNVJFIJW-UHFFFAOYSA-N
Compound name
1-amino-3-piperidin-1-ylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

240
Patents

158.1419 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.14918 138.0
[M+Na]+ 181.13112 141.1
[M-H]- 157.13462 137.1
[M+NH4]+ 176.17572 155.8
[M+K]+ 197.10506 139.7
[M+H-H2O]+ 141.13916 131.3
[M+HCOO]- 203.14010 155.2
[M+CH3COO]- 217.15575 176.5
[M+Na-2H]- 179.11657 141.1
[M]+ 158.14135 130.8
[M]- 158.14245 130.8
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