CID 130736039

124182-92-9

Structural Information

Molecular Formula
C10H14O
SMILES
C1CC12C[C@H]3CC(=O)C[C@H]3C2
InChI
InChI=1S/C10H14O/c11-9-3-7-5-10(1-2-10)6-8(7)4-9/h7-8H,1-6H2/t7-,8+
InChIKey
KGVUVEAYEGQDRD-OCAPTIKFSA-N
Compound name
(3aS,6aR)-spiro[1,3,3a,4,6,6a-hexahydropentalene-5,1'-cyclopropane]-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

150.10446 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.11174 136.4
[M+Na]+ 173.09368 147.4
[M+NH4]+ 168.13828 148.5
[M+K]+ 189.06762 143.8
[M-H]- 149.09718 145.7
[M+Na-2H]- 171.07913 143.6
[M]+ 150.10391 141.7
[M]- 150.10501 141.7
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.