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

11
Patents

137.04768 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.05496 126.7
[M+Na]+ 160.03690 138.1
[M-H]- 136.04040 134.1
[M+NH4]+ 155.08150 142.9
[M+K]+ 176.01084 136.8
[M+H-H2O]+ 120.04494 120.2
[M+HCOO]- 182.04588 151.1
[M+CH3COO]- 196.06153 174.5
[M+Na-2H]- 158.02235 134.0
[M]+ 137.04713 131.3
[M]- 137.04823 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