CID 5200689

2-(4-bromophenoxy)-n'-(4-tert-butylcyclohexylidene)acetohydrazide

Structural Information

Molecular Formula
C18H25BrN2O2
SMILES
CC(C)(C)C1CCC(=NNC(=O)COC2=CC=C(C=C2)Br)CC1
InChI
InChI=1S/C18H25BrN2O2/c1-18(2,3)13-4-8-15(9-5-13)20-21-17(22)12-23-16-10-6-14(19)7-11-16/h6-7,10-11,13H,4-5,8-9,12H2,1-3H3,(H,21,22)
InChIKey
GCVHOQNNWCKVLK-UHFFFAOYSA-N
Compound name
2-(4-bromophenoxy)-N-[(4-tert-butylcyclohexylidene)amino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

380.10995 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.11723 184.8
[M+Na]+ 403.09917 190.7
[M-H]- 379.10267 193.5
[M+NH4]+ 398.14377 200.2
[M+K]+ 419.07311 179.3
[M+H-H2O]+ 363.10721 182.1
[M+HCOO]- 425.10815 202.6
[M+CH3COO]- 439.12380 219.4
[M+Na-2H]- 401.08462 187.9
[M]+ 380.10940 200.8
[M]- 380.11050 200.8
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.