CID 51038580

Schembl1309529

Structural Information

Molecular Formula
C15H30N2O3
SMILES
CN(C)CCCNC(=O)CCCCCCCCC(=O)O
InChI
InChI=1S/C15H30N2O3/c1-17(2)13-9-12-16-14(18)10-7-5-3-4-6-8-11-15(19)20/h3-13H2,1-2H3,(H,16,18)(H,19,20)
InChIKey
GWKPWGKMVDEOGQ-UHFFFAOYSA-N
Compound name
10-[3-(dimethylamino)propylamino]-10-oxodecanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

286.22565 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.23293 175.5
[M+Na]+ 309.21487 177.0
[M-H]- 285.21837 174.1
[M+NH4]+ 304.25947 190.3
[M+K]+ 325.18881 176.1
[M+H-H2O]+ 269.22291 168.1
[M+HCOO]- 331.22385 196.4
[M+CH3COO]- 345.23950 210.2
[M+Na-2H]- 307.20032 174.4
[M]+ 286.22510 179.3
[M]- 286.22620 179.3
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

patents stripe