CID 45923682

1284220-47-8

Structural Information

Molecular Formula
C7H8N2O
SMILES
C1CC1C2=CC(=NN2)C=O
InChI
InChI=1S/C7H8N2O/c10-4-6-3-7(9-8-6)5-1-2-5/h3-5H,1-2H2,(H,8,9)
InChIKey
OCFFEKPDYIAVOV-UHFFFAOYSA-N
Compound name
5-cyclopropyl-1H-pyrazole-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

136.06366 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.07094 130.6
[M+Na]+ 159.05288 141.5
[M-H]- 135.05638 134.5
[M+NH4]+ 154.09748 146.0
[M+K]+ 175.02682 137.5
[M+H-H2O]+ 119.06092 123.4
[M+HCOO]- 181.06186 153.2
[M+CH3COO]- 195.07751 172.7
[M+Na-2H]- 157.03833 136.2
[M]+ 136.06311 131.7
[M]- 136.06421 131.7
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