CID 71370740

65286-55-7

Structural Information

Molecular Formula
C13H31N3O2
SMILES
CN(C)CCOCCN(C)CCOCCN(C)C
InChI
InChI=1S/C13H31N3O2/c1-14(2)6-10-17-12-8-16(5)9-13-18-11-7-15(3)4/h6-13H2,1-5H3
InChIKey
HDVDXVSXWCMDAI-UHFFFAOYSA-N
Compound name
2-[2-[2-[2-(dimethylamino)ethoxy]ethyl-methylamino]ethoxy]-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

54
Patents

261.24164 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.24892 169.8
[M+Na]+ 284.23086 171.9
[M-H]- 260.23436 172.9
[M+NH4]+ 279.27546 187.5
[M+K]+ 300.20480 174.9
[M+H-H2O]+ 244.23890 161.5
[M+HCOO]- 306.23984 196.2
[M+CH3COO]- 320.25549 217.4
[M+Na-2H]- 282.21631 171.3
[M]+ 261.24109 177.9
[M]- 261.24219 177.9
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