CID 233605

934-90-7

Structural Information

Molecular Formula
C8H17NO
SMILES
CC(CN1CCCCC1)O
InChI
InChI=1S/C8H17NO/c1-8(10)7-9-5-3-2-4-6-9/h8,10H,2-7H2,1H3
InChIKey
UCASFSAKVJTSET-UHFFFAOYSA-N
Compound name
1-piperidin-1-ylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

423
Patents

143.13101 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 134.0
[M+Na]+ 166.12023 138.0
[M-H]- 142.12373 133.7
[M+NH4]+ 161.16483 153.1
[M+K]+ 182.09417 137.1
[M+H-H2O]+ 126.12827 127.8
[M+HCOO]- 188.12921 150.9
[M+CH3COO]- 202.14486 172.2
[M+Na-2H]- 164.10568 137.9
[M]+ 143.13046 128.6
[M]- 143.13156 128.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe