CID 39892

N'-(2,6-diethylphenyl)-n,n-dimethylformamidine

Structural Information

Molecular Formula
C13H20N2
SMILES
CCC1=C(C(=CC=C1)CC)N=CN(C)C
InChI
InChI=1S/C13H20N2/c1-5-11-8-7-9-12(6-2)13(11)14-10-15(3)4/h7-10H,5-6H2,1-4H3
InChIKey
MSRNLIPPGMGDIC-UHFFFAOYSA-N
Compound name
N'-(2,6-diethylphenyl)-N,N-dimethylmethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

204.16264 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.169916 148.4
[M+Na]+ 227.151858 155.3
[M-H]- 203.155364 154.9
[M+NH4]+ 222.196463 168.9
[M+K]+ 243.125798 154.0
[M+H-H2O]+ 187.159900 141.4
[M+HCOO]- 249.160841 175.9
[M+CH3COO]- 263.176491 200.1
[M+Na-2H]- 225.137306 153.4
[M]+ 204.16209142 151.4
[M]- 204.16318858 151.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe