CID 9557598

N'-(2-furylmethylene)-2-(2-isopropyl-5-methylphenoxy)acetohydrazide

Structural Information

Molecular Formula
C17H20N2O3
SMILES
CC1=CC(=C(C=C1)C(C)C)OCC(=O)N/N=C/C2=CC=CO2
InChI
InChI=1S/C17H20N2O3/c1-12(2)15-7-6-13(3)9-16(15)22-11-17(20)19-18-10-14-5-4-8-21-14/h4-10,12H,11H2,1-3H3,(H,19,20)/b18-10+
InChIKey
XARCVNREHYHFGU-VCHYOVAHSA-N
Compound name
N-[(E)-furan-2-ylmethylideneamino]-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

300.1474 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.15468 173.0
[M+Na]+ 323.13662 178.7
[M-H]- 299.14012 181.7
[M+NH4]+ 318.18122 188.5
[M+K]+ 339.11056 177.5
[M+H-H2O]+ 283.14466 164.8
[M+HCOO]- 345.14560 198.8
[M+CH3COO]- 359.16125 210.6
[M+Na-2H]- 321.12207 175.2
[M]+ 300.14685 177.2
[M]- 300.14795 177.2
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.