CID 9793804

80141-51-1

Structural Information

Molecular Formula
C4H6Cl2O
SMILES
C[C@H](CCl)C(=O)Cl
InChI
InChI=1S/C4H6Cl2O/c1-3(2-5)4(6)7/h3H,2H2,1H3/t3-/m1/s1
InChIKey
REBZXOIBOIJEAU-GSVOUGTGSA-N
Compound name
(2R)-3-chloro-2-methylpropanoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

123
Patents

139.97957 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.98685 122.2
[M+Na]+ 162.96879 134.3
[M+NH4]+ 158.01339 131.1
[M+K]+ 178.94273 128.5
[M-H]- 138.97229 121.6
[M+Na-2H]- 160.95424 126.8
[M]+ 139.97902 124.2
[M]- 139.98012 124.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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