CID 76510

3083-11-2

Structural Information

Molecular Formula
C15H37N5
SMILES
CN(C)CCN(C)CCN(C)CCN(C)CCN(C)C
InChI
InChI=1S/C15H37N5/c1-16(2)8-10-18(5)12-14-20(7)15-13-19(6)11-9-17(3)4/h8-15H2,1-7H3
InChIKey
SZYLDXKMZNIHDQ-UHFFFAOYSA-N
Compound name
N'-[2-[2-[2-(dimethylamino)ethyl-methylamino]ethyl-methylamino]ethyl]-N,N,N'-trimethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

351
Patents

287.3049 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.31218 182.6
[M+Na]+ 310.29412 182.7
[M-H]- 286.29762 188.4
[M+NH4]+ 305.33872 199.9
[M+K]+ 326.26806 187.2
[M+H-H2O]+ 270.30216 173.0
[M+HCOO]- 332.30310 210.7
[M+CH3COO]- 346.31875 236.3
[M+Na-2H]- 308.27957 181.9
[M]+ 287.30435 189.5
[M]- 287.30545 189.5
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