CID 13813829

1-methyl-3-methylidenecyclobutane

Structural Information

Molecular Formula
C6H10
SMILES
CC1CC(=C)C1
InChI
InChI=1S/C6H10/c1-5-3-6(2)4-5/h6H,1,3-4H2,2H3
InChIKey
BXYZBFOEWUJGTP-UHFFFAOYSA-N
Compound name
1-methyl-3-methylidenecyclobutane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

82.07825 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 83.085526 111.4
[M+Na]+ 105.067468 118.6
[M-H]- 81.070974 115.5
[M+NH4]+ 100.112073 129.4
[M+K]+ 121.041408 120.7
[M+H-H2O]+ 65.075510 102.8
[M+HCOO]- 127.076451 133.9
[M+CH3COO]- 141.092101 169.3
[M+Na-2H]- 103.052916 118.2
[M]+ 82.07770142 118.3
[M]- 82.07879858 118.3
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