CID 12682595

(2-anilinophenyl)methanol

Structural Information

Molecular Formula

C₁₃H₁₃NO

SMILES

C1=CC=C(C=C1)NC2=CC=CC=C2CO

InChI

InChI=1S/C13H13NO/c15-10-11-6-4-5-9-13(11)14-12-7-2-1-3-8-12/h1-9,14-15H,10H2

InChIKey

ULYQVUSFLDDMAB-UHFFFAOYSA-N

Compound name

(2-anilinophenyl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 20
Patents: 199.09972 Da
Monoisotopic Mass: 3.7
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]+	200.10700	144.2
[M+Na]+	222.08894	158.5
[M+NH4]+	217.13354	153.6
[M+K]+	238.06288	150.3
[M-H]-	198.09244	149.7
[M+Na-2H]-	220.07439	154.6
[M]+	199.09917	147.8
[M]-	199.10027	147.8

Literature stripe

literature stripe

Patent stripe

patents stripe