CID 4108135

Alpha-(3,5-xylylimino)-o-cresol

Structural Information

Molecular Formula

C₁₅H₁₅NO

SMILES

CC1=CC(=CC(=C1)N=CC2=CC=CC=C2O)C

InChI

InChI=1S/C15H15NO/c1-11-7-12(2)9-14(8-11)16-10-13-5-3-4-6-15(13)17/h3-10,17H,1-2H3

InChIKey

CYZZXVVZGARMGX-UHFFFAOYSA-N

Compound name

2-[(3,5-dimethylphenyl)iminomethyl]phenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 225.11537 Da
Monoisotopic Mass: 3.8
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]+	226.122646	150.1
[M+Na]+	248.104588	158.7
[M-H]-	224.108094	157.5
[M+NH4]+	243.149193	168.5
[M+K]+	264.078528	154.5
[M+H-H2O]+	208.112630	142.9
[M+HCOO]-	270.113571	175.7
[M+CH3COO]-	284.129221	193.8
[M+Na-2H]-	246.090036	155.9
[M]+	225.11482142	150.7
[M]-	225.11591858	150.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe