CID 55303019

[1-(chloromethyl)cyclobutyl]methanol

Structural Information

Molecular Formula
C6H11ClO
SMILES
C1CC(C1)(CO)CCl
InChI
InChI=1S/C6H11ClO/c7-4-6(5-8)2-1-3-6/h8H,1-5H2
InChIKey
NKGCLLHUUJCSQF-UHFFFAOYSA-N
Compound name
[1-(chloromethyl)cyclobutyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

134.04984 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.05712 121.5
[M+Na]+ 157.03906 128.7
[M-H]- 133.04256 123.9
[M+NH4]+ 152.08366 139.2
[M+K]+ 173.01300 128.6
[M+H-H2O]+ 117.04710 114.6
[M+HCOO]- 179.04804 138.3
[M+CH3COO]- 193.06369 171.7
[M+Na-2H]- 155.02451 129.0
[M]+ 134.04929 130.2
[M]- 134.05039 130.2
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.