CID 131029127

72184-73-7

Structural Information

Molecular Formula
C7H10O3
SMILES
C1COC(O1)[C@@H]2C[C@H]2C=O
InChI
InChI=1S/C7H10O3/c8-4-5-3-6(5)7-9-1-2-10-7/h4-7H,1-3H2/t5-,6+/m0/s1
InChIKey
SBGQPMZSRRWOFF-NTSWFWBYSA-N
Compound name
(1R,2R)-2-(1,3-dioxolan-2-yl)cyclopropane-1-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.06299 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.07027 126.3
[M+Na]+ 165.05221 135.7
[M-H]- 141.05571 135.2
[M+NH4]+ 160.09681 142.1
[M+K]+ 181.02615 136.6
[M+H-H2O]+ 125.06025 120.8
[M+HCOO]- 187.06119 148.1
[M+CH3COO]- 201.07684 174.8
[M+Na-2H]- 163.03766 133.1
[M]+ 142.06244 129.8
[M]- 142.06354 129.8
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

No patent data available for this compound.