CID 19104142

[1-(2-aminoethyl)piperidin-4-yl]methanol dihydrochloride

Structural Information

Molecular Formula
C8H18N2O
SMILES
C1CN(CCC1CO)CCN
InChI
InChI=1S/C8H18N2O/c9-3-6-10-4-1-8(7-11)2-5-10/h8,11H,1-7,9H2
InChIKey
GSPGIVPZQUNHRX-UHFFFAOYSA-N
Compound name
[1-(2-aminoethyl)piperidin-4-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

45
Patents

158.1419 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.14918 137.4
[M+Na]+ 181.13112 141.8
[M-H]- 157.13462 136.8
[M+NH4]+ 176.17572 155.7
[M+K]+ 197.10506 139.9
[M+H-H2O]+ 141.13916 130.9
[M+HCOO]- 203.14010 155.7
[M+CH3COO]- 217.15575 176.7
[M+Na-2H]- 179.11657 141.1
[M]+ 158.14135 131.3
[M]- 158.14245 131.3
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