CID 61242820

{4-[(propan-2-yl)amino]piperidin-4-yl}methanol dihydrochloride

Structural Information

Molecular Formula
C9H20N2O
SMILES
CC(C)NC1(CCNCC1)CO
InChI
InChI=1S/C9H20N2O/c1-8(2)11-9(7-12)3-5-10-6-4-9/h8,10-12H,3-7H2,1-2H3
InChIKey
UIXASGLQDYPRTR-UHFFFAOYSA-N
Compound name
[4-(propan-2-ylamino)piperidin-4-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
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 142.3
[M+Na]+ 195.146778 145.5
[M-H]- 171.150284 140.7
[M+NH4]+ 190.191383 161.2
[M+K]+ 211.120718 143.6
[M+H-H2O]+ 155.154820 136.6
[M+HCOO]- 217.155761 158.4
[M+CH3COO]- 231.171411 177.2
[M+Na-2H]- 193.132226 146.6
[M]+ 172.15701142 134.9
[M]- 172.15810858 134.9
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

No patent data available for this compound.