CID 9658856

N'-(2-(allyloxy)benzylidene)-2-(4-nitrophenoxy)acetohydrazide

Structural Information

Molecular Formula
C18H17N3O5
SMILES
C=CCOC1=CC=CC=C1/C=N/NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C18H17N3O5/c1-2-11-25-17-6-4-3-5-14(17)12-19-20-18(22)13-26-16-9-7-15(8-10-16)21(23)24/h2-10,12H,1,11,13H2,(H,20,22)/b19-12+
InChIKey
CMZUUJUUBYYZGI-XDHOZWIPSA-N
Compound name
2-(4-nitrophenoxy)-N-[(E)-(2-prop-2-enoxyphenyl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.11682 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.12410 181.2
[M+Na]+ 378.10604 184.8
[M-H]- 354.10954 188.6
[M+NH4]+ 373.15064 192.4
[M+K]+ 394.07998 177.8
[M+H-H2O]+ 338.11408 175.8
[M+HCOO]- 400.11502 208.7
[M+CH3COO]- 414.13067 213.1
[M+Na-2H]- 376.09149 187.2
[M]+ 355.11627 182.6
[M]- 355.11737 182.6
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.