CID 118678

Lauryl aminopropylglycine

Structural Information

Molecular Formula
C17H36N2O2
SMILES
CCCCCCCCCCCCNCCCNCC(=O)O
InChI
InChI=1S/C17H36N2O2/c1-2-3-4-5-6-7-8-9-10-11-13-18-14-12-15-19-16-17(20)21/h18-19H,2-16H2,1H3,(H,20,21)
InChIKey
FDKNTODVCFVEDJ-UHFFFAOYSA-N
Compound name
2-[3-(dodecylamino)propylamino]acetic acid
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

635
Patents

300.27768 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.28496 180.8
[M+Na]+ 323.26690 181.1
[M-H]- 299.27040 177.4
[M+NH4]+ 318.31150 194.5
[M+K]+ 339.24084 177.9
[M+H-H2O]+ 283.27494 173.1
[M+HCOO]- 345.27588 201.1
[M+CH3COO]- 359.29153 211.5
[M+Na-2H]- 321.25235 180.7
[M]+ 300.27713 184.1
[M]- 300.27823 184.1
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

patents stripe