CID 9588214

3-pyridinecarboxaldehyde, o-(1,1-dimethylethyl)oxime, monohydrochloride

Structural Information

Molecular Formula
C10H14N2O
SMILES
CC(C)(C)O/N=C/C1=CN=CC=C1
InChI
InChI=1S/C10H14N2O/c1-10(2,3)13-12-8-9-5-4-6-11-7-9/h4-8H,1-3H3/b12-8+
InChIKey
AOCNXFGYANIRKA-XYOKQWHBSA-N
Compound name
(E)-N-[(2-methylpropan-2-yl)oxy]-1-pyridin-3-ylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

178.11061 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.11789 139.3
[M+Na]+ 201.09983 146.8
[M-H]- 177.10333 143.0
[M+NH4]+ 196.14443 158.8
[M+K]+ 217.07377 145.8
[M+H-H2O]+ 161.10787 132.5
[M+HCOO]- 223.10881 163.7
[M+CH3COO]- 237.12446 184.6
[M+Na-2H]- 199.08528 148.6
[M]+ 178.11006 141.4
[M]- 178.11116 141.4
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.