CID 20289364

2,2,3,3-tetramethylcyclopropane-1-carbaldehyde

Structural Information

Molecular Formula
C8H14O
SMILES
CC1(C(C1(C)C)C=O)C
InChI
InChI=1S/C8H14O/c1-7(2)6(5-9)8(7,3)4/h5-6H,1-4H3
InChIKey
IQBFNXYAKGOFOB-UHFFFAOYSA-N
Compound name
2,2,3,3-tetramethylcyclopropane-1-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

121
Patents

126.10446 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.11174 127.6
[M+Na]+ 149.09368 141.0
[M+NH4]+ 144.13828 139.7
[M+K]+ 165.06762 133.2
[M-H]- 125.09718 136.2
[M+Na-2H]- 147.07913 138.3
[M]+ 126.10391 133.4
[M]- 126.10501 133.4
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