CID 21917506

1399672-44-6

Structural Information

Molecular Formula
C7H10O2
SMILES
C/C(=C\C1CC1)/C(=O)O
InChI
InChI=1S/C7H10O2/c1-5(7(8)9)4-6-2-3-6/h4,6H,2-3H2,1H3,(H,8,9)/b5-4+
InChIKey
ZPSRHBWFNNDPCQ-SNAWJCMRSA-N
Compound name
(E)-3-cyclopropyl-2-methylprop-2-enoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

126.06808 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.07536 127.3
[M+Na]+ 149.05730 138.3
[M+NH4]+ 144.10190 135.4
[M+K]+ 165.03124 135.5
[M-H]- 125.06080 133.8
[M+Na-2H]- 147.04275 133.6
[M]+ 126.06753 131.5
[M]- 126.06863 131.5
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