CID 10558787

70918-95-5

Structural Information

Molecular Formula

C₉H₁₄N₂

SMILES

CC(C)NC1=CC=CC=C1N

InChI

InChI=1S/C9H14N2/c1-7(2)11-9-6-4-3-5-8(9)10/h3-7,11H,10H2,1-2H3

InChIKey

NUANSJJRMWHEHS-UHFFFAOYSA-N

Compound name

2-N-propan-2-ylbenzene-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 290
Patents: 150.11569 Da
Monoisotopic Mass: 2.0
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]+	151.12297	132.8
[M+Na]+	173.10491	144.0
[M+NH4]+	168.14951	141.7
[M+K]+	189.07885	137.9
[M-H]-	149.10841	136.4
[M+Na-2H]-	171.09036	139.9
[M]+	150.11514	135.2
[M]-	150.11624	135.2

Literature stripe

literature stripe

Patent stripe

patents stripe