CID 155081

68104-02-9

Structural Information

Molecular Formula

C₁₀H₁₆N₂O

SMILES

CC1=CC(=C(C=C1N)OC)N(C)C

InChI

InChI=1S/C10H16N2O/c1-7-5-9(12(2)3)10(13-4)6-8(7)11/h5-6H,11H2,1-4H3

InChIKey

INGHQCVNNYVDFR-UHFFFAOYSA-N

Compound name

2-methoxy-1-N,1-N,5-trimethylbenzene-1,4-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 24
Patents: 180.12627 Da
Monoisotopic Mass: 1.7
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]+	181.13355	139.8
[M+Na]+	203.11549	151.6
[M+NH4]+	198.16009	148.3
[M+K]+	219.08943	145.9
[M-H]-	179.11899	143.4
[M+Na-2H]-	201.10094	146.3
[M]+	180.12572	142.4
[M]-	180.12682	142.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe