CID 18712959

3-(1-methylpiperidin-2-yl)propan-1-ol

Structural Information

Molecular Formula
C9H19NO
SMILES
CN1CCCCC1CCCO
InChI
InChI=1S/C9H19NO/c1-10-7-3-2-5-9(10)6-4-8-11/h9,11H,2-8H2,1H3
InChIKey
HWWPNXULQJLWBJ-UHFFFAOYSA-N
Compound name
3-(1-methylpiperidin-2-yl)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

157.14667 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.153946 137.8
[M+Na]+ 180.135888 142.6
[M-H]- 156.139394 137.7
[M+NH4]+ 175.180493 156.8
[M+K]+ 196.109828 141.0
[M+H-H2O]+ 140.143930 131.6
[M+HCOO]- 202.144871 155.4
[M+CH3COO]- 216.160521 175.5
[M+Na-2H]- 178.121336 141.8
[M]+ 157.14612142 133.9
[M]- 157.14721858 133.9
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

patents stripe