CID 25323879

1-[4-(1h-1,2,4-triazol-1-yl)phenyl]ethanone oxime

Structural Information

Molecular Formula
C10H10N4O
SMILES
C/C(=N/O)/C1=CC=C(C=C1)N2C=NC=N2
InChI
InChI=1S/C10H10N4O/c1-8(13-15)9-2-4-10(5-3-9)14-7-11-6-12-14/h2-7,15H,1H3/b13-8-
InChIKey
VVOXRSCTXMFUFJ-JYRVWZFOSA-N
Compound name
(NZ)-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.08546 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.09274 143.2
[M+Na]+ 225.07468 155.5
[M+NH4]+ 220.11928 150.1
[M+K]+ 241.04862 151.7
[M-H]- 201.07818 145.2
[M+Na-2H]- 223.06013 151.2
[M]+ 202.08491 145.2
[M]- 202.08601 145.2
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.