CID 717550

302549-69-5

Structural Information

Molecular Formula
C19H22N2O3
SMILES
CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=CC=C(C=C2)C(=O)N
InChI
InChI=1S/C19H22N2O3/c1-12(2)16-9-4-13(3)10-17(16)24-11-18(22)21-15-7-5-14(6-8-15)19(20)23/h4-10,12H,11H2,1-3H3,(H2,20,23)(H,21,22)
InChIKey
QKFLCYJNSJOHBB-UHFFFAOYSA-N
Compound name
4-[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]amino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

326.16306 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.170336 179.2
[M+Na]+ 349.152278 184.1
[M-H]- 325.155784 185.4
[M+NH4]+ 344.196883 192.2
[M+K]+ 365.126218 181.2
[M+H-H2O]+ 309.160320 170.6
[M+HCOO]- 371.161261 201.3
[M+CH3COO]- 385.176911 216.7
[M+Na-2H]- 347.137726 178.5
[M]+ 326.16251142 179.7
[M]- 326.16360858 179.7
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.