CID 53399407

(4-methoxy-1-methylpiperidin-4-yl)methanol hydrochloride

Structural Information

Molecular Formula
C8H17NO2
SMILES
CN1CCC(CC1)(CO)OC
InChI
InChI=1S/C8H17NO2/c1-9-5-3-8(7-10,11-2)4-6-9/h10H,3-7H2,1-2H3
InChIKey
BEFRSOORJLKENY-UHFFFAOYSA-N
Compound name
(4-methoxy-1-methylpiperidin-4-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

159.12593 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.13321 135.6
[M+Na]+ 182.11515 141.7
[M-H]- 158.11865 136.0
[M+NH4]+ 177.15975 156.5
[M+K]+ 198.08909 141.1
[M+H-H2O]+ 142.12319 130.3
[M+HCOO]- 204.12413 153.7
[M+CH3COO]- 218.13978 174.1
[M+Na-2H]- 180.10060 141.3
[M]+ 159.12538 133.0
[M]- 159.12648 133.0
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