CID 22657

N,n-dibenzylethanolamine

Structural Information

Molecular Formula
C16H19NO
SMILES
C1=CC=C(C=C1)CN(CCO)CC2=CC=CC=C2
InChI
InChI=1S/C16H19NO/c18-12-11-17(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16/h1-10,18H,11-14H2
InChIKey
WTTWSMJHJFNCQB-UHFFFAOYSA-N
Compound name
2-(dibenzylamino)ethanol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

3
References

1159
Patents

241.14667 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.15395 158.0
[M+Na]+ 264.13589 171.5
[M+NH4]+ 259.18049 167.2
[M+K]+ 280.10983 162.9
[M-H]- 240.13939 163.6
[M+Na-2H]- 262.12134 168.1
[M]+ 241.14612 161.6
[M]- 241.14722 161.6
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