CID 57483077

Aminopropyl laurylglutamine

Structural Information

Molecular Formula
C20H41N3O3
SMILES
CCCCCCCCCCCCN(CCCN)[C@@H](CCC(=O)N)C(=O)O
InChI
InChI=1S/C20H41N3O3/c1-2-3-4-5-6-7-8-9-10-11-16-23(17-12-15-21)18(20(25)26)13-14-19(22)24/h18H,2-17,21H2,1H3,(H2,22,24)(H,25,26)/t18-/m0/s1
InChIKey
JKQIRCYJESXZOC-SFHVURJKSA-N
Compound name
(2S)-5-amino-2-[3-aminopropyl(dodecyl)amino]-5-oxopentanoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

605
Patents

371.3148 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.32208 201.1
[M+Na]+ 394.30402 199.3
[M-H]- 370.30752 197.7
[M+NH4]+ 389.34862 210.5
[M+K]+ 410.27796 197.4
[M+H-H2O]+ 354.31206 192.4
[M+HCOO]- 416.31300 210.2
[M+CH3COO]- 430.32865 230.6
[M+Na-2H]- 392.28947 194.5
[M]+ 371.31425 203.3
[M]- 371.31535 203.3
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.