CID 12019499

3-[methyl(piperidin-4-yl)amino]propan-1-ol

Structural Information

Molecular Formula
C9H20N2O
SMILES
CN(CCCO)C1CCNCC1
InChI
InChI=1S/C9H20N2O/c1-11(7-2-8-12)9-3-5-10-6-4-9/h9-10,12H,2-8H2,1H3
InChIKey
RSMGBDMEDZHITB-UHFFFAOYSA-N
Compound name
3-[methyl(piperidin-4-yl)amino]propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

172.15756 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.164836 142.0
[M+Na]+ 195.146778 144.7
[M-H]- 171.150284 141.4
[M+NH4]+ 190.191383 159.6
[M+K]+ 211.120718 143.4
[M+H-H2O]+ 155.154820 135.1
[M+HCOO]- 217.155761 159.6
[M+CH3COO]- 231.171411 180.1
[M+Na-2H]- 193.132226 145.7
[M]+ 172.15701142 136.2
[M]- 172.15810858 136.2
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