CID 55219210

2-[(2-aminophenyl)amino]-3-phenylpropan-1-ol

Structural Information

Molecular Formula
C15H18N2O
SMILES
C1=CC=C(C=C1)CC(CO)NC2=CC=CC=C2N
InChI
InChI=1S/C15H18N2O/c16-14-8-4-5-9-15(14)17-13(11-18)10-12-6-2-1-3-7-12/h1-9,13,17-18H,10-11,16H2
InChIKey
CKIJJUWZUOYYAR-UHFFFAOYSA-N
Compound name
2-(2-aminoanilino)-3-phenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

242.1419 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.14918 155.7
[M+Na]+ 265.13112 160.3
[M-H]- 241.13462 160.2
[M+NH4]+ 260.17572 171.2
[M+K]+ 281.10506 155.9
[M+H-H2O]+ 225.13916 147.9
[M+HCOO]- 287.14010 178.9
[M+CH3COO]- 301.15575 195.9
[M+Na-2H]- 263.11657 160.6
[M]+ 242.14135 152.0
[M]- 242.14245 152.0
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

patents stripe