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]+ 155.08151 130.1
[M+Na]+ 177.06345 138.8
[M-H]- 153.06695 134.8
[M+NH4]+ 172.10805 150.9
[M+K]+ 193.03739 140.1
[M+H-H2O]+ 137.07149 123.7
[M+HCOO]- 199.07243 156.0
[M+CH3COO]- 213.08808 180.5
[M+Na-2H]- 175.04890 136.8
[M]+ 154.07368 134.1
[M]- 154.07478 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