CID 573077

Cyclopentanecarboxaldehyde, 2-methyl-3-methylene-

Structural Information

Molecular Formula
C8H12O
SMILES
CC1C(CCC1=C)C=O
InChI
InChI=1S/C8H12O/c1-6-3-4-8(5-9)7(6)2/h5,7-8H,1,3-4H2,2H3
InChIKey
PVKIIZQXWDDNDN-UHFFFAOYSA-N
Compound name
2-methyl-3-methylidenecyclopentane-1-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

124.08881 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.096086 124.7
[M+Na]+ 147.078028 132.9
[M-H]- 123.081534 128.5
[M+NH4]+ 142.122633 149.2
[M+K]+ 163.051968 131.3
[M+H-H2O]+ 107.086070 120.5
[M+HCOO]- 169.087011 148.0
[M+CH3COO]- 183.102661 171.7
[M+Na-2H]- 145.063476 128.0
[M]+ 124.08826142 122.9
[M]- 124.08935858 122.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.