CID 170901253

Piljlkqtutuepj-uhfffaoysa-n

Structural Information

Molecular Formula
C11H24N2O5
SMILES
CC(COC(=O)NCCCN(CCO)CCO)O
InChI
InChI=1S/C11H24N2O5/c1-10(16)9-18-11(17)12-3-2-4-13(5-7-14)6-8-15/h10,14-16H,2-9H2,1H3,(H,12,17)
InChIKey
PILJLKQTUTUEPJ-UHFFFAOYSA-N
Compound name
2-hydroxypropyl N-[3-[bis(2-hydroxyethyl)amino]propyl]carbamate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

264.16852 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.17580 163.7
[M+Na]+ 287.15774 165.5
[M-H]- 263.16124 160.1
[M+NH4]+ 282.20234 177.9
[M+K]+ 303.13168 165.7
[M+H-H2O]+ 247.16578 156.8
[M+HCOO]- 309.16672 183.1
[M+CH3COO]- 323.18237 197.8
[M+Na-2H]- 285.14319 163.8
[M]+ 264.16797 165.6
[M]- 264.16907 165.6
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.