CID 81096742

1-(2-aminoethyl)-4-methylpiperidin-4-ol dihydrochloride

Structural Information

Molecular Formula
C8H18N2O
SMILES
CC1(CCN(CC1)CCN)O
InChI
InChI=1S/C8H18N2O/c1-8(11)2-5-10(6-3-8)7-4-9/h11H,2-7,9H2,1H3
InChIKey
ULBPNBYMHRZLEF-UHFFFAOYSA-N
Compound name
1-(2-aminoethyl)-4-methylpiperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
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 136.8
[M+Na]+ 181.13112 142.2
[M-H]- 157.13462 136.7
[M+NH4]+ 176.17572 157.2
[M+K]+ 197.10506 140.6
[M+H-H2O]+ 141.13916 131.4
[M+HCOO]- 203.14010 155.2
[M+CH3COO]- 217.15575 176.3
[M+Na-2H]- 179.11657 141.8
[M]+ 158.14135 131.1
[M]- 158.14245 131.1
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