CID 13419581

98009-90-6

Structural Information

Molecular Formula
C8H17NO
SMILES
CC1CNCCC1CCO
InChI
InChI=1S/C8H17NO/c1-7-6-9-4-2-8(7)3-5-10/h7-10H,2-6H2,1H3
InChIKey
PYVUXEULPSUTEE-UHFFFAOYSA-N
Compound name
2-(3-methylpiperidin-4-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

143.13101 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 134.2
[M+Na]+ 166.12023 139.0
[M-H]- 142.12373 132.8
[M+NH4]+ 161.16483 153.0
[M+K]+ 182.09417 136.6
[M+H-H2O]+ 126.12827 128.4
[M+HCOO]- 188.12921 150.5
[M+CH3COO]- 202.14486 169.9
[M+Na-2H]- 164.10568 138.1
[M]+ 143.13046 127.9
[M]- 143.13156 127.9
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