CID 571831

Gb-104

Structural Information

Molecular Formula
C11H15N3O2
SMILES
CN(C)C(=O)CN(C1=CC=CC=C1)C(=O)N
InChI
InChI=1S/C11H15N3O2/c1-13(2)10(15)8-14(11(12)16)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H2,12,16)
InChIKey
ROYZKJRJZXUEFD-UHFFFAOYSA-N
Compound name
2-(N-carbamoylanilino)-N,N-dimethylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.11642 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.12370 151.0
[M+Na]+ 244.10564 155.3
[M-H]- 220.10914 156.7
[M+NH4]+ 239.15024 169.0
[M+K]+ 260.07958 156.3
[M+H-H2O]+ 204.11368 143.3
[M+HCOO]- 266.11462 177.2
[M+CH3COO]- 280.13027 201.3
[M+Na-2H]- 242.09109 153.9
[M]+ 221.11587 150.9
[M]- 221.11697 150.9
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.