CID 62389913

2-ethyl-2-methylcyclopropane-1-carboxylic acid

Structural Information

Molecular Formula
C7H12O2
SMILES
CCC1(CC1C(=O)O)C
InChI
InChI=1S/C7H12O2/c1-3-7(2)4-5(7)6(8)9/h5H,3-4H2,1-2H3,(H,8,9)
InChIKey
NFZQLMTWIZTMJI-UHFFFAOYSA-N
Compound name
2-ethyl-2-methylcyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

128.08372 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.09100 128.1
[M+Na]+ 151.07294 139.9
[M+NH4]+ 146.11754 137.9
[M+K]+ 167.04688 135.0
[M-H]- 127.07644 135.3
[M+Na-2H]- 149.05839 136.2
[M]+ 128.08317 132.9
[M]- 128.08427 132.9
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