CID 56416

Brn 0683147

Structural Information

Molecular Formula
C14H17N3O3
SMILES
CC1=NOC(=C1CCOC)NC(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C14H17N3O3/c1-9-12(7-8-19-2)14(20-17-9)16-13(18)10-3-5-11(15)6-4-10/h3-6H,7-8,15H2,1-2H3,(H,16,18)
InChIKey
UDVNSZOBOZPUTL-UHFFFAOYSA-N
Compound name
4-amino-N-[4-(2-methoxyethyl)-3-methyl-1,2-oxazol-5-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.12698 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.13426 163.8
[M+Na]+ 298.11620 171.2
[M-H]- 274.11970 170.1
[M+NH4]+ 293.16080 178.4
[M+K]+ 314.09014 169.4
[M+H-H2O]+ 258.12424 155.5
[M+HCOO]- 320.12518 188.0
[M+CH3COO]- 334.14083 203.1
[M+Na-2H]- 296.10165 166.6
[M]+ 275.12643 166.4
[M]- 275.12753 166.4
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

No patent data available for this compound.