CID 16227496

N-[2-(1h-1,3-benzodiazol-2-yl)-1-(furan-2-yl)ethylidene]hydroxylamine

Structural Information

Molecular Formula
C13H11N3O2
SMILES
C1=CC=C2C(=C1)NC(=N2)C/C(=N/O)/C3=CC=CO3
InChI
InChI=1S/C13H11N3O2/c17-16-11(12-6-3-7-18-12)8-13-14-9-4-1-2-5-10(9)15-13/h1-7,17H,8H2,(H,14,15)/b16-11-
InChIKey
FHEQCGZTZCRMLB-WJDWOHSUSA-N
Compound name
(NZ)-N-[2-(1H-benzimidazol-2-yl)-1-(furan-2-yl)ethylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.08513 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.09241 150.3
[M+Na]+ 264.07435 159.1
[M-H]- 240.07785 155.7
[M+NH4]+ 259.11895 167.2
[M+K]+ 280.04829 156.0
[M+H-H2O]+ 224.08239 142.7
[M+HCOO]- 286.08333 173.5
[M+CH3COO]- 300.09898 163.1
[M+Na-2H]- 262.05980 156.3
[M]+ 241.08458 151.9
[M]- 241.08568 151.9
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.