CID 128711

Cga 140408

Structural Information

Molecular Formula
C23H32N2O
SMILES
CC(C)C1=CC(=CC(=C1N=C(C(C)(C)C)N)C(C)C)OC2=CC=CC=C2
InChI
InChI=1S/C23H32N2O/c1-15(2)19-13-18(26-17-11-9-8-10-12-17)14-20(16(3)4)21(19)25-22(24)23(5,6)7/h8-16H,1-7H3,(H2,24,25)
InChIKey
UQUMOFBCKNKCHK-UHFFFAOYSA-N
Compound name
2,2-dimethyl-N'-[4-phenoxy-2,6-di(propan-2-yl)phenyl]propanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

352.25146 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.258736 190.9
[M+Na]+ 375.240678 195.0
[M-H]- 351.244184 198.1
[M+NH4]+ 370.285283 204.0
[M+K]+ 391.214618 191.9
[M+H-H2O]+ 335.248720 182.5
[M+HCOO]- 397.249661 210.9
[M+CH3COO]- 411.265311 227.2
[M+Na-2H]- 373.226126 189.4
[M]+ 352.25091142 192.0
[M]- 352.25200858 192.0
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.