CID 231198

(2e)-2-{[4-(dimethylamino)phenyl]imino}-1-phenylethan-1-one

Structural Information

Molecular Formula
C16H16N2O
SMILES
CN(C)C1=CC=C(C=C1)N=CC(=O)C2=CC=CC=C2
InChI
InChI=1S/C16H16N2O/c1-18(2)15-10-8-14(9-11-15)17-12-16(19)13-6-4-3-5-7-13/h3-12H,1-2H3
InChIKey
UYNRNKVSHIPCJL-UHFFFAOYSA-N
Compound name
2-[4-(dimethylamino)phenyl]imino-1-phenylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.12627 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.133546 158.4
[M+Na]+ 275.115488 164.2
[M-H]- 251.118994 167.5
[M+NH4]+ 270.160093 175.7
[M+K]+ 291.089428 161.8
[M+H-H2O]+ 235.123530 149.6
[M+HCOO]- 297.124471 185.7
[M+CH3COO]- 311.140121 205.5
[M+Na-2H]- 273.100936 163.8
[M]+ 252.12572142 159.5
[M]- 252.12681858 159.5
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