CID 95788684

1903835-66-4

Structural Information

Molecular Formula
C8H12O2
SMILES
C1CC(C1)[C@@H]2C[C@H]2C(=O)O
InChI
InChI=1S/C8H12O2/c9-8(10)7-4-6(7)5-2-1-3-5/h5-7H,1-4H2,(H,9,10)/t6-,7+/m0/s1
InChIKey
OAPKUMLJROYWHA-NKWVEPMBSA-N
Compound name
(1R,2S)-2-cyclobutylcyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

140.08372 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.09100 129.8
[M+Na]+ 163.07294 137.0
[M+NH4]+ 158.11754 134.9
[M+K]+ 179.04688 135.7
[M-H]- 139.07644 135.4
[M+Na-2H]- 161.05839 134.8
[M]+ 140.08317 132.2
[M]- 140.08427 132.2
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.