CID 5143531

2-((1,1'-biphenyl)-4-yloxy)-n'-(4-methylcyclohexylidene)propanohydrazide

Structural Information

Molecular Formula
C22H26N2O2
SMILES
CC1CCC(=NNC(=O)C(C)OC2=CC=C(C=C2)C3=CC=CC=C3)CC1
InChI
InChI=1S/C22H26N2O2/c1-16-8-12-20(13-9-16)23-24-22(25)17(2)26-21-14-10-19(11-15-21)18-6-4-3-5-7-18/h3-7,10-11,14-17H,8-9,12-13H2,1-2H3,(H,24,25)
InChIKey
ZNGPOMMRASFZGW-UHFFFAOYSA-N
Compound name
N-[(4-methylcyclohexylidene)amino]-2-(4-phenylphenoxy)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.19943 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.20671 185.6
[M+Na]+ 373.18865 187.3
[M-H]- 349.19215 194.9
[M+NH4]+ 368.23325 197.5
[M+K]+ 389.16259 183.5
[M+H-H2O]+ 333.19669 175.2
[M+HCOO]- 395.19763 206.5
[M+CH3COO]- 409.21328 220.6
[M+Na-2H]- 371.17410 186.3
[M]+ 350.19888 181.6
[M]- 350.19998 181.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.