CID 37402

36192-18-4

Structural Information

Molecular Formula
C12H18N2
SMILES
CC1=CC(=C(C(=C1)C)N=CN(C)C)C
InChI
InChI=1S/C12H18N2/c1-9-6-10(2)12(11(3)7-9)13-8-14(4)5/h6-8H,1-5H3
InChIKey
KKEQDORUHMADQW-UHFFFAOYSA-N
Compound name
N,N-dimethyl-N'-(2,4,6-trimethylphenyl)methanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2
Patents

190.147 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.15428 144.5
[M+Na]+ 213.13622 157.3
[M+NH4]+ 208.18082 153.6
[M+K]+ 229.11016 149.9
[M-H]- 189.13972 149.1
[M+Na-2H]- 211.12167 151.9
[M]+ 190.14645 147.6
[M]- 190.14755 147.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe