CID 65439312

1-chloro-3-ethoxycyclobutane

Structural Information

Molecular Formula
C6H11ClO
SMILES
CCOC1CC(C1)Cl
InChI
InChI=1S/C6H11ClO/c1-2-8-6-3-5(7)4-6/h5-6H,2-4H2,1H3
InChIKey
VVCBEBZKGNEAOW-UHFFFAOYSA-N
Compound name
1-chloro-3-ethoxycyclobutane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

134.04984 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.05712 118.9
[M+Na]+ 157.03906 126.5
[M-H]- 133.04256 122.5
[M+NH4]+ 152.08366 135.6
[M+K]+ 173.01300 127.4
[M+H-H2O]+ 117.04710 110.7
[M+HCOO]- 179.04804 137.0
[M+CH3COO]- 193.06369 175.9
[M+Na-2H]- 155.02451 125.3
[M]+ 134.04929 129.5
[M]- 134.05039 129.5
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

No patent data available for this compound.