CID 3020199

84878-47-7

Structural Information

Molecular Formula
C20H20N2O
SMILES
C1=CC=C(C(=C1)CC2=CC=CC=C2NCC3=CC=CC=C3O)N
InChI
InChI=1S/C20H20N2O/c21-18-10-4-1-7-15(18)13-16-8-2-5-11-19(16)22-14-17-9-3-6-12-20(17)23/h1-12,22-23H,13-14,21H2
InChIKey
CPFZPORDJIEQNC-UHFFFAOYSA-N
Compound name
2-[[2-[(2-aminophenyl)methyl]anilino]methyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.15756 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.164836 172.0
[M+Na]+ 327.146778 177.9
[M-H]- 303.150284 179.8
[M+NH4]+ 322.191383 185.0
[M+K]+ 343.120718 171.3
[M+H-H2O]+ 287.154820 162.8
[M+HCOO]- 349.155761 195.7
[M+CH3COO]- 363.171411 182.4
[M+Na-2H]- 325.132226 176.6
[M]+ 304.15701142 168.9
[M]- 304.15810858 168.9
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

No patent data available for this compound.