CID 145874414

2375273-56-4

Structural Information

Molecular Formula
C10H21NO2
SMILES
CC(C)C(C)CN(C)CCC(=O)O
InChI
InChI=1S/C10H21NO2/c1-8(2)9(3)7-11(4)6-5-10(12)13/h8-9H,5-7H2,1-4H3,(H,12,13)
InChIKey
MMGLDVHAFDFSKF-UHFFFAOYSA-N
Compound name
3-[2,3-dimethylbutyl(methyl)amino]propanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.15723 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.16451 146.2
[M+Na]+ 210.14645 153.4
[M+NH4]+ 205.19105 152.5
[M+K]+ 226.12039 150.1
[M-H]- 186.14995 144.8
[M+Na-2H]- 208.13190 147.4
[M]+ 187.15668 146.4
[M]- 187.15778 146.4
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.