CID 12962868

1,2-dimethylcyclopropane-1-carbaldehyde

Structural Information

Molecular Formula
C6H10O
SMILES
CC1CC1(C)C=O
InChI
InChI=1S/C6H10O/c1-5-3-6(5,2)4-7/h4-5H,3H2,1-2H3
InChIKey
OHFSZUCYHXAZPX-UHFFFAOYSA-N
Compound name
1,2-dimethylcyclopropane-1-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

107
Patents

98.073166 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 99.080442 118.7
[M+Na]+ 121.06238 129.7
[M-H]- 97.065890 124.3
[M+NH4]+ 116.10699 139.5
[M+K]+ 137.03632 129.1
[M+H-H2O]+ 81.070426 114.8
[M+HCOO]- 143.07137 142.8
[M+CH3COO]- 157.08702 171.3
[M+Na-2H]- 119.04783 126.8
[M]+ 98.072617 122.6
[M]- 98.073715 122.6
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