CID 5362587

Cyclobutyl chloroformate

Structural Information

Molecular Formula
C5H7ClO2
SMILES
C1CC(C1)OC(=O)Cl
InChI
InChI=1S/C5H7ClO2/c6-5(7)8-4-2-1-3-4/h4H,1-3H2
InChIKey
QPOSYIIMLMZMAZ-UHFFFAOYSA-N
Compound name
cyclobutyl carbonochloridate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

323
Patents

134.01346 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.02074 117.2
[M+Na]+ 157.00268 124.3
[M-H]- 133.00618 120.8
[M+NH4]+ 152.04728 133.5
[M+K]+ 172.97662 125.9
[M+H-H2O]+ 117.01072 108.8
[M+HCOO]- 179.01166 135.2
[M+CH3COO]- 193.02731 173.0
[M+Na-2H]- 154.98813 123.5
[M]+ 134.01291 127.2
[M]- 134.01401 127.2
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

patents stripe