CID 56813

Brn 2749606

Structural Information

Molecular Formula
C17H18N2O2
SMILES
CN(C)C(=O)CN(C1=CC=CC=C1)C(=O)C2=CC=CC=C2
InChI
InChI=1S/C17H18N2O2/c1-18(2)16(20)13-19(15-11-7-4-8-12-15)17(21)14-9-5-3-6-10-14/h3-12H,13H2,1-2H3
InChIKey
CMVLQJBLPAUYFB-UHFFFAOYSA-N
Compound name
N-[2-(dimethylamino)-2-oxoethyl]-N-phenylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.13684 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.14412 167.1
[M+Na]+ 305.12606 170.9
[M-H]- 281.12956 175.9
[M+NH4]+ 300.17066 182.7
[M+K]+ 321.10000 170.0
[M+H-H2O]+ 265.13410 158.0
[M+HCOO]- 327.13504 192.3
[M+CH3COO]- 341.15069 210.5
[M+Na-2H]- 303.11151 170.3
[M]+ 282.13629 168.3
[M]- 282.13739 168.3
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

No patent data available for this compound.