CID 40648466

3-[(3s)-piperidin-3-yl]propan-1-olhydrochloride

Structural Information

Molecular Formula
C8H17NO
SMILES
C1C[C@@H](CNC1)CCCO
InChI
InChI=1S/C8H17NO/c10-6-2-4-8-3-1-5-9-7-8/h8-10H,1-7H2/t8-/m1/s1
InChIKey
CHCGEJVYCWSXML-MRVPVSSYSA-N
Compound name
3-[(3R)-piperidin-3-yl]propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

143.13101 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 134.3
[M+Na]+ 166.12023 138.1
[M-H]- 142.12373 132.5
[M+NH4]+ 161.16483 152.8
[M+K]+ 182.09417 135.8
[M+H-H2O]+ 126.12827 128.3
[M+HCOO]- 188.12921 150.7
[M+CH3COO]- 202.14486 168.8
[M+Na-2H]- 164.10568 139.0
[M]+ 143.13046 127.7
[M]- 143.13156 127.7
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