CID 155542324

Egpi-1?

Structural Information

Molecular Formula
C17H10F5N3S
SMILES
C1=CC(=CC=C1C2=CSC(=N2)N/N=C/C3=CC(=C(C=C3)F)F)C(F)(F)F
InChI
InChI=1S/C17H10F5N3S/c18-13-6-1-10(7-14(13)19)8-23-25-16-24-15(9-26-16)11-2-4-12(5-3-11)17(20,21)22/h1-9H,(H,24,25)/b23-8+
InChIKey
XDKIXIWBMYDGIV-LIMNOBDPSA-N
Compound name
N-[(E)-(3,4-difluorophenyl)methylideneamino]-4-[4-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

383.05154 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 384.05882 180.7
[M+Na]+ 406.04076 191.3
[M-H]- 382.04426 184.9
[M+NH4]+ 401.08536 193.7
[M+K]+ 422.01470 183.3
[M+H-H2O]+ 366.04880 167.5
[M+HCOO]- 428.04974 196.7
[M+CH3COO]- 442.06539 221.5
[M+Na-2H]- 404.02621 180.8
[M]+ 383.05099 177.5
[M]- 383.05209 177.5
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

No patent data available for this compound.