CID 3021304

Brn 5970720

Structural Information

Molecular Formula
C14H10ClNO4
SMILES
C1=CC=C(C(=C1)C(=O)OC2=CC=CC=C2Cl)OC(=O)N
InChI
InChI=1S/C14H10ClNO4/c15-10-6-2-4-8-12(10)19-13(17)9-5-1-3-7-11(9)20-14(16)18/h1-8H,(H2,16,18)
InChIKey
ZBULHIWAZTVVQS-UHFFFAOYSA-N
Compound name
(2-chlorophenyl) 2-carbamoyloxybenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.02985 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.03713 161.3
[M+Na]+ 314.01907 174.8
[M+NH4]+ 309.06367 168.5
[M+K]+ 329.99301 168.8
[M-H]- 290.02257 164.8
[M+Na-2H]- 312.00452 169.2
[M]+ 291.02930 164.4
[M]- 291.03040 164.4
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.