CID 9570370

Cetoxime

Structural Information

Molecular Formula
C15H17N3O
SMILES
C1=CC=C(C=C1)CN(C/C(=N/O)/N)C2=CC=CC=C2
InChI
InChI=1S/C15H17N3O/c16-15(17-19)12-18(14-9-5-2-6-10-14)11-13-7-3-1-4-8-13/h1-10,19H,11-12H2,(H2,16,17)
InChIKey
GOAZMLKQUGCOPO-UHFFFAOYSA-N
Compound name
2-(N-benzylanilino)-N'-hydroxyethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

712
Patents

255.13716 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.14444 158.4
[M+Na]+ 278.12638 162.1
[M-H]- 254.12988 165.3
[M+NH4]+ 273.17098 174.0
[M+K]+ 294.10032 159.4
[M+H-H2O]+ 238.13442 149.6
[M+HCOO]- 300.13536 184.8
[M+CH3COO]- 314.15101 204.1
[M+Na-2H]- 276.11183 164.2
[M]+ 255.13661 156.0
[M]- 255.13771 156.0
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.