CID 3022028

Brn 0986625

Structural Information

Molecular Formula
C11H19N3O2
SMILES
CCN(CC)C(C)C(=O)NC1=CC(=NO1)C
InChI
InChI=1S/C11H19N3O2/c1-5-14(6-2)9(4)11(15)12-10-7-8(3)13-16-10/h7,9H,5-6H2,1-4H3,(H,12,15)
InChIKey
YPZLSPPUNFPXMD-UHFFFAOYSA-N
Compound name
2-(diethylamino)-N-(3-methyl-1,2-oxazol-5-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.14772 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.15500 155.3
[M+Na]+ 248.13694 160.8
[M-H]- 224.14044 159.5
[M+NH4]+ 243.18154 172.7
[M+K]+ 264.11088 162.0
[M+H-H2O]+ 208.14498 147.6
[M+HCOO]- 270.14592 178.8
[M+CH3COO]- 284.16157 198.7
[M+Na-2H]- 246.12239 157.6
[M]+ 225.14717 158.6
[M]- 225.14827 158.6
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.