CID 211188

P-bis(2-ethanolaminopropyl)benzene dihydrochloride

Structural Information

Molecular Formula
C16H24N2O2
SMILES
CC1(CN1CCO)C2=CC=C(C=C2)C3(CN3CCO)C
InChI
InChI=1S/C16H24N2O2/c1-15(11-17(15)7-9-19)13-3-5-14(6-4-13)16(2)12-18(16)8-10-20/h3-6,19-20H,7-12H2,1-2H3
InChIKey
MQYPXIRSRIQPQO-UHFFFAOYSA-N
Compound name
2-[2-[4-[1-(2-hydroxyethyl)-2-methylaziridin-2-yl]phenyl]-2-methylaziridin-1-yl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.18378 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.19106 147.8
[M+Na]+ 299.17300 161.3
[M+NH4]+ 294.21760 157.4
[M+K]+ 315.14694 156.5
[M-H]- 275.17650 162.6
[M+Na-2H]- 297.15845 161.2
[M]+ 276.18323 156.2
[M]- 276.18433 156.2
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.