CID 55301007

15136-06-8

Structural Information

Molecular Formula
C7H10O2
SMILES
C1CC1[C@H]2C[C@@H]2C(=O)O
InChI
InChI=1S/C7H10O2/c8-7(9)6-3-5(6)4-1-2-4/h4-6H,1-3H2,(H,8,9)/t5-,6+/m1/s1
InChIKey
MZCSKKFXNXGUGR-RITPCOANSA-N
Compound name
(1S,2R)-2-cyclopropylcyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

126.06808 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.07536 133.6
[M+Na]+ 149.05730 141.6
[M-H]- 125.06080 140.1
[M+NH4]+ 144.10190 143.6
[M+K]+ 165.03124 139.9
[M+H-H2O]+ 109.06534 128.3
[M+HCOO]- 171.06628 152.9
[M+CH3COO]- 185.08193 184.2
[M+Na-2H]- 147.04275 136.9
[M]+ 126.06753 136.6
[M]- 126.06863 136.6
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

No patent data available for this compound.