CID 9625751

2-(4-bromophenoxy)-n'-(1-methyl-3-phenyl-2-propenylidene)acetohydrazide

Structural Information

Molecular Formula
C18H17BrN2O2
SMILES
C/C(=N\NC(=O)COC1=CC=C(C=C1)Br)/C=C/C2=CC=CC=C2
InChI
InChI=1S/C18H17BrN2O2/c1-14(7-8-15-5-3-2-4-6-15)20-21-18(22)13-23-17-11-9-16(19)10-12-17/h2-12H,13H2,1H3,(H,21,22)/b8-7+,20-14+
InChIKey
IMZAMHWOOXJFFU-BSNOEWQHSA-N
Compound name
2-(4-bromophenoxy)-N-[(E)-[(E)-4-phenylbut-3-en-2-ylidene]amino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

372.04733 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.05461 179.5
[M+Na]+ 395.03655 186.8
[M-H]- 371.04005 188.8
[M+NH4]+ 390.08115 194.8
[M+K]+ 411.01049 174.5
[M+H-H2O]+ 355.04459 176.0
[M+HCOO]- 417.04553 202.1
[M+CH3COO]- 431.06118 216.9
[M+Na-2H]- 393.02200 184.1
[M]+ 372.04678 198.3
[M]- 372.04788 198.3
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.