CID 170757

15-amino-4,7,10,13-tetraazapentadecan-2-ol

Structural Information

Molecular Formula
C11H29N5O
SMILES
CC(CNCCNCCNCCNCCN)O
InChI
InChI=1S/C11H29N5O/c1-11(17)10-16-9-8-15-7-6-14-5-4-13-3-2-12/h11,13-17H,2-10,12H2,1H3
InChIKey
LQZFWZLHIHJDMC-UHFFFAOYSA-N
Compound name
1-[2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]ethylamino]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

247.23721 Da
Monoisotopic Mass

-2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.24449 158.0
[M+Na]+ 270.22643 158.1
[M-H]- 246.22993 155.2
[M+NH4]+ 265.27103 172.5
[M+K]+ 286.20037 156.7
[M+H-H2O]+ 230.23447 149.9
[M+HCOO]- 292.23541 182.2
[M+CH3COO]- 306.25106 207.6
[M+Na-2H]- 268.21188 161.2
[M]+ 247.23666 154.9
[M]- 247.23776 154.9
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