CID 361540

41890-12-4

Structural Information

Molecular Formula

C₉H₁₂N₂

SMILES

CN(C)C(=N)C1=CC=CC=C1

InChI

InChI=1S/C9H12N2/c1-11(2)9(10)8-6-4-3-5-7-8/h3-7,10H,1-2H3

InChIKey

LNIGFYSAOIMZNA-UHFFFAOYSA-N

Compound name

N,N-dimethylbenzenecarboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 112
Patents: 148.10005 Da
Monoisotopic Mass: 0.7
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]+	149.107326	131.6
[M+Na]+	171.089268	137.5
[M-H]-	147.092774	136.6
[M+NH4]+	166.133873	152.8
[M+K]+	187.063208	136.8
[M+H-H2O]+	131.097310	125.2
[M+HCOO]-	193.098251	157.9
[M+CH3COO]-	207.113901	183.8
[M+Na-2H]-	169.074716	138.4
[M]+	148.09950142	129.8
[M]-	148.10059858	129.8

Literature stripe

literature stripe

Patent stripe

patents stripe