CID 24841275

Brn 3403715

Structural Information

Molecular Formula
C20H28N2O
SMILES
CCN(CC)CCN(C1=CC=CC=C1)C(CO)C2=CC=CC=C2
InChI
InChI=1S/C20H28N2O/c1-3-21(4-2)15-16-22(19-13-9-6-10-14-19)20(17-23)18-11-7-5-8-12-18/h5-14,20,23H,3-4,15-17H2,1-2H3
InChIKey
PQRFUPGXJPSATD-UHFFFAOYSA-N
Compound name
2-[N-[2-(diethylamino)ethyl]anilino]-2-phenylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.22015 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.227426 179.5
[M+Na]+ 335.209368 181.1
[M-H]- 311.212874 185.9
[M+NH4]+ 330.253973 193.2
[M+K]+ 351.183308 178.6
[M+H-H2O]+ 295.217410 169.9
[M+HCOO]- 357.218351 202.4
[M+CH3COO]- 371.234001 216.9
[M+Na-2H]- 333.194816 181.7
[M]+ 312.21960142 180.5
[M]- 312.22069858 180.5
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.