CID 146155924

Rac-tert-butyl (1r,2r)-2-(2-chloroacetyl)cyclopropane-1-carboxylate

Structural Information

Molecular Formula
C10H15ClO3
SMILES
CC(C)(C)OC(=O)[C@@H]1C[C@H]1C(=O)CCl
InChI
InChI=1S/C10H15ClO3/c1-10(2,3)14-9(13)7-4-6(7)8(12)5-11/h6-7H,4-5H2,1-3H3/t6-,7-/m1/s1
InChIKey
MTGUJCHUQNNTOC-RNFRBKRXSA-N
Compound name
tert-butyl (1R,2R)-2-(2-chloroacetyl)cyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.07097 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.07825 143.9
[M+Na]+ 241.06019 153.4
[M-H]- 217.06369 148.6
[M+NH4]+ 236.10479 158.9
[M+K]+ 257.03413 150.1
[M+H-H2O]+ 201.06823 139.6
[M+HCOO]- 263.06917 160.1
[M+CH3COO]- 277.08482 190.4
[M+Na-2H]- 239.04564 147.0
[M]+ 218.07042 151.1
[M]- 218.07152 151.1
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.