CID 77463

2,6,10-trimethyl-2,6,10-triazaundecane

Structural Information

Molecular Formula
C11H27N3
SMILES
CN(C)CCCN(C)CCCN(C)C
InChI
InChI=1S/C11H27N3/c1-12(2)8-6-10-14(5)11-7-9-13(3)4/h6-11H2,1-5H3
InChIKey
SKCNNQDRNPQEFU-UHFFFAOYSA-N
Compound name
N'-[3-(dimethylamino)propyl]-N,N,N'-trimethylpropane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

2090
Patents

201.2205 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.22778 155.1
[M+Na]+ 224.20972 158.1
[M-H]- 200.21322 158.8
[M+NH4]+ 219.25432 175.4
[M+K]+ 240.18366 160.7
[M+H-H2O]+ 184.21776 147.7
[M+HCOO]- 246.21870 181.6
[M+CH3COO]- 260.23435 207.6
[M+Na-2H]- 222.19517 157.6
[M]+ 201.21995 159.6
[M]- 201.22105 159.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe