CID 64964

1,4,8,11-tetraazacyclotetradecane

Structural Information

Molecular Formula
C10H24N4
SMILES
C1CNCCNCCCNCCNC1
InChI
InChI=1S/C10H24N4/c1-3-11-7-9-13-5-2-6-14-10-8-12-4-1/h11-14H,1-10H2
InChIKey
MDAXKAUIABOHTD-UHFFFAOYSA-N
Compound name
1,4,8,11-tetrazacyclotetradecane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

343
References

9831
Patents

200.2001 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.20738 152.2
[M+Na]+ 223.18932 151.8
[M-H]- 199.19282 141.2
[M+NH4]+ 218.23392 159.1
[M+K]+ 239.16326 148.1
[M+H-H2O]+ 183.19736 146.1
[M+HCOO]- 245.19830 157.1
[M+CH3COO]- 259.21395 156.5
[M+Na-2H]- 221.17477 153.6
[M]+ 200.19955 131.9
[M]- 200.20065 131.9
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