CID 12461956

5771-62-0

Structural Information

Molecular Formula
C10H8O
SMILES
C1C2C1C(=O)C3=CC=CC=C23
InChI
InChI=1S/C10H8O/c11-10-7-4-2-1-3-6(7)8-5-9(8)10/h1-4,8-9H,5H2
InChIKey
MYLRFVFSHGOPFU-UHFFFAOYSA-N
Compound name
1a,6a-dihydro-1H-cyclopropa[a]inden-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

144.05751 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.06479 127.3
[M+Na]+ 167.04673 139.8
[M-H]- 143.05023 134.2
[M+NH4]+ 162.09133 148.1
[M+K]+ 183.02067 135.5
[M+H-H2O]+ 127.05477 122.5
[M+HCOO]- 189.05571 150.8
[M+CH3COO]- 203.07136 142.5
[M+Na-2H]- 165.03218 135.1
[M]+ 144.05696 130.8
[M]- 144.05806 130.8
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.