CID 82125017

1267443-15-1

Structural Information

Molecular Formula
C7H7NO2
SMILES
C1CC1C2=NC=C(O2)C=O
InChI
InChI=1S/C7H7NO2/c9-4-6-3-8-7(10-6)5-1-2-5/h3-5H,1-2H2
InChIKey
RMYLHMXQZVNBLW-UHFFFAOYSA-N
Compound name
2-cyclopropyl-1,3-oxazole-5-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

137.04768 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.054956 126.7
[M+Na]+ 160.036898 138.1
[M-H]- 136.040404 134.1
[M+NH4]+ 155.081503 142.9
[M+K]+ 176.010838 136.8
[M+H-H2O]+ 120.044940 120.2
[M+HCOO]- 182.045881 151.1
[M+CH3COO]- 196.061531 174.5
[M+Na-2H]- 158.022346 134.0
[M]+ 137.04713142 131.3
[M]- 137.04822858 131.3
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