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]+ 135.057116 118.9
[M+Na]+ 157.039058 126.5
[M-H]- 133.042564 122.5
[M+NH4]+ 152.083663 135.6
[M+K]+ 173.012998 127.4
[M+H-H2O]+ 117.047100 110.7
[M+HCOO]- 179.048041 137.0
[M+CH3COO]- 193.063691 175.9
[M+Na-2H]- 155.024506 125.3
[M]+ 134.04929142 129.5
[M]- 134.05038858 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.