CID 10068207

Fr-167356

Structural Information

Molecular Formula
C19H17Cl2NO3
SMILES
CC1=C(C2=C(O1)C(=CC=C2)NC(=O)C3=C(C=CC=C3Cl)Cl)C(C)(C)O
InChI
InChI=1S/C19H17Cl2NO3/c1-10-16(19(2,3)24)11-6-4-9-14(17(11)25-10)22-18(23)15-12(20)7-5-8-13(15)21/h4-9,24H,1-3H3,(H,22,23)
InChIKey
GCAOVMKRBUCSET-UHFFFAOYSA-N
Compound name
2,6-dichloro-N-[3-(2-hydroxypropan-2-yl)-2-methyl-1-benzofuran-7-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

5
Patents

377.05856 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.06584 187.0
[M+Na]+ 400.04778 202.4
[M+NH4]+ 395.09238 194.9
[M+K]+ 416.02172 196.6
[M-H]- 376.05128 192.0
[M+Na-2H]- 398.03323 193.1
[M]+ 377.05801 191.5
[M]- 377.05911 191.5
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