CID 24848458

Dtxsid901028381

Structural Information

Molecular Formula
C19H21F2NO2
SMILES
CCOC1=C(C=CC(=C1)C(C)(C)C)NC(=O)C2=C(C=CC=C2F)F
InChI
InChI=1S/C19H21F2NO2/c1-5-24-16-11-12(19(2,3)4)9-10-15(16)22-18(23)17-13(20)7-6-8-14(17)21/h6-11H,5H2,1-4H3,(H,22,23)
InChIKey
BYUBYQBNINRDFT-UHFFFAOYSA-N
Compound name
N-(4-tert-butyl-2-ethoxyphenyl)-2,6-difluorobenzamide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

0
Patents

333.15402 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.16130 178.2
[M+Na]+ 356.14324 186.1
[M-H]- 332.14674 182.7
[M+NH4]+ 351.18784 192.3
[M+K]+ 372.11718 181.8
[M+H-H2O]+ 316.15128 168.8
[M+HCOO]- 378.15222 197.8
[M+CH3COO]- 392.16787 215.2
[M+Na-2H]- 354.12869 179.5
[M]+ 333.15347 178.6
[M]- 333.15457 178.6
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.