CID 113720

63690-20-0

Structural Information

Molecular Formula
C11H21NO2
SMILES
CC1CCCCN1C(C)CCC(=O)O
InChI
InChI=1S/C11H21NO2/c1-9-5-3-4-8-12(9)10(2)6-7-11(13)14/h9-10H,3-8H2,1-2H3,(H,13,14)
InChIKey
LTXYOPKSTZSMLG-UHFFFAOYSA-N
Compound name
4-(2-methylpiperidin-1-yl)pentanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.15723 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.16451 148.3
[M+Na]+ 222.14645 157.1
[M+NH4]+ 217.19105 155.2
[M+K]+ 238.12039 152.4
[M-H]- 198.14995 148.0
[M+Na-2H]- 220.13190 150.7
[M]+ 199.15668 149.1
[M]- 199.15778 149.1
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

No patent data available for this compound.