CID 3456097

2728150-16-9

Structural Information

Molecular Formula

C₁₀H₁₅N

SMILES

CC1=CC(=C(C(=C1C)N)C)C

InChI

InChI=1S/C10H15N/c1-6-5-7(2)9(4)10(11)8(6)3/h5H,11H2,1-4H3

InChIKey

ZCZPJZYQBNOPLT-UHFFFAOYSA-N

Compound name

2,3,5,6-tetramethylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 453
Patents: 149.12045 Da
Monoisotopic Mass: 2.7
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]+	150.12773	131.8
[M+Na]+	172.10967	145.6
[M+NH4]+	167.15427	141.3
[M+K]+	188.08361	138.7
[M-H]-	148.11317	135.6
[M+Na-2H]-	170.09512	138.8
[M]+	149.11990	134.9
[M]-	149.12100	134.9

Literature stripe

literature stripe

Patent stripe

patents stripe