CID 20099055

893749-69-4

Structural Information

Molecular Formula
C7H10N2O2
SMILES
CN(C)CC1=CC(=NO1)C=O
InChI
InChI=1S/C7H10N2O2/c1-9(2)4-7-3-6(5-10)8-11-7/h3,5H,4H2,1-2H3
InChIKey
XAIIKHPABHSAAX-UHFFFAOYSA-N
Compound name
5-[(dimethylamino)methyl]-1,2-oxazole-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

154.07423 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.081506 130.1
[M+Na]+ 177.063448 138.8
[M-H]- 153.066954 134.8
[M+NH4]+ 172.108053 150.9
[M+K]+ 193.037388 140.1
[M+H-H2O]+ 137.071490 123.7
[M+HCOO]- 199.072431 156.0
[M+CH3COO]- 213.088081 180.5
[M+Na-2H]- 175.048896 136.8
[M]+ 154.07368142 134.1
[M]- 154.07477858 134.1
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