CID 2125524

5-(phenoxymethyl)furan-2-carbohydrazide

Structural Information

Molecular Formula
C12H12N2O3
SMILES
C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NN
InChI
InChI=1S/C12H12N2O3/c13-14-12(15)11-7-6-10(17-11)8-16-9-4-2-1-3-5-9/h1-7H,8,13H2,(H,14,15)
InChIKey
DWKKGVSUBJSFCU-UHFFFAOYSA-N
Compound name
5-(phenoxymethyl)furan-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

4
Patents

232.0848 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.09208 149.7
[M+Na]+ 255.07402 156.1
[M-H]- 231.07752 156.9
[M+NH4]+ 250.11862 166.8
[M+K]+ 271.04796 154.9
[M+H-H2O]+ 215.08206 142.3
[M+HCOO]- 277.08300 175.9
[M+CH3COO]- 291.09865 191.9
[M+Na-2H]- 253.05947 155.1
[M]+ 232.08425 150.3
[M]- 232.08535 150.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe