CID 12117

N,n'-diphenylacetamidine

Structural Information

Molecular Formula
C14H14N2
SMILES
CC(=NC1=CC=CC=C1)NC2=CC=CC=C2
InChI
InChI=1S/C14H14N2/c1-12(15-13-8-4-2-5-9-13)16-14-10-6-3-7-11-14/h2-11H,1H3,(H,15,16)
InChIKey
CLWIJUQLAFJNOF-UHFFFAOYSA-N
Compound name
N,N'-diphenylethanimidamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

11
References

125
Patents

210.11569 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.12297 146.7
[M+Na]+ 233.10491 152.2
[M-H]- 209.10841 154.4
[M+NH4]+ 228.14951 165.1
[M+K]+ 249.07885 148.9
[M+H-H2O]+ 193.11295 138.7
[M+HCOO]- 255.11389 173.9
[M+CH3COO]- 269.12954 193.1
[M+Na-2H]- 231.09036 154.9
[M]+ 210.11514 144.8
[M]- 210.11624 144.8
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