CID 6871299

1132-03-2

Structural Information

Molecular Formula
C9H10N2O2
SMILES
CC1=CC=CC=C1NC(=O)/C=N/O
InChI
InChI=1S/C9H10N2O2/c1-7-4-2-3-5-8(7)11-9(12)6-10-13/h2-6,13H,1H3,(H,11,12)/b10-6+
InChIKey
XLFBDBCQQNVKHU-UXBLZVDNSA-N
Compound name
(2E)-2-hydroxyimino-N-(2-methylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

56
Patents

178.07423 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.08151 136.3
[M+Na]+ 201.06345 143.3
[M-H]- 177.06695 140.3
[M+NH4]+ 196.10805 155.9
[M+K]+ 217.03739 141.6
[M+H-H2O]+ 161.07149 129.9
[M+HCOO]- 223.07243 162.8
[M+CH3COO]- 237.08808 184.1
[M+Na-2H]- 199.04890 143.1
[M]+ 178.07368 135.7
[M]- 178.07478 135.7
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