CID 470781

1,4,8,11-tetraazacyclopentadecane

Structural Information

Molecular Formula
C11H26N4
SMILES
C1CCNCCNCCCNCCNC1
InChI
InChI=1S/C11H26N4/c1-2-5-13-9-11-15-7-3-6-14-10-8-12-4-1/h12-15H,1-11H2
InChIKey
DYZDEGISFJEHAA-UHFFFAOYSA-N
Compound name
1,4,8,11-tetrazacyclopentadecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

17
Patents

214.21574 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.22302 156.0
[M+Na]+ 237.20496 155.0
[M-H]- 213.20846 145.1
[M+NH4]+ 232.24956 162.2
[M+K]+ 253.17890 151.1
[M+H-H2O]+ 197.21300 149.8
[M+HCOO]- 259.21394 160.1
[M+CH3COO]- 273.22959 159.8
[M+Na-2H]- 235.19041 156.8
[M]+ 214.21519 134.9
[M]- 214.21629 134.9
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

No patent data available for this compound.