CID 160310

Foe 3440a

Structural Information

Molecular Formula
C18H21Cl2NO4Si
SMILES
CC(C(=O)OC[Si](C)(C)C)OC1=CC=C(C=C1)OC2=C(C=C(C=N2)Cl)Cl
InChI
InChI=1S/C18H21Cl2NO4Si/c1-12(18(22)23-11-26(2,3)4)24-14-5-7-15(8-6-14)25-17-16(20)9-13(19)10-21-17/h5-10,12H,11H2,1-4H3
InChIKey
BTWJOUJEKBEAIW-UHFFFAOYSA-N
Compound name
trimethylsilylmethyl 2-[4-(3,5-dichloropyridin-2-yl)oxyphenoxy]propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

71
Patents

413.06168 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 414.06896 191.3
[M+Na]+ 436.05090 205.4
[M+NH4]+ 431.09550 197.5
[M+K]+ 452.02484 198.5
[M-H]- 412.05440 193.1
[M+Na-2H]- 434.03635 197.7
[M]+ 413.06113 194.5
[M]- 413.06223 194.5
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