CID 10084

467-62-9

Structural Information

Molecular Formula

C₁₉H₁₉N₃O

SMILES

C1=CC(=CC=C1C(C2=CC=C(C=C2)N)(C3=CC=C(C=C3)N)O)N

InChI

InChI=1S/C19H19N3O/c20-16-7-1-13(2-8-16)19(23,14-3-9-17(21)10-4-14)15-5-11-18(22)12-6-15/h1-12,23H,20-22H2

InChIKey

KRVRUAYUNOQMOV-UHFFFAOYSA-N

Compound name

tris(4-aminophenyl)methanol

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 1
References: 406
Patents: 305.1528 Da
Monoisotopic Mass: 2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	306.16008	175.0
[M+Na]+	328.14202	187.8
[M+NH4]+	323.18662	182.8
[M+K]+	344.11596	180.9
[M-H]-	304.14552	182.5
[M+Na-2H]-	326.12747	185.1
[M]+	305.15225	178.9
[M]-	305.15335	178.9

Literature stripe

literature stripe

Patent stripe

patents stripe