CID 5355485

6-methyl-2-pyridinealdoxime o-isoamyl ether

Structural Information

Molecular Formula
C12H18N2O
SMILES
CC1=NC(=CC=C1)/C=N\OCCC(C)C
InChI
InChI=1S/C12H18N2O/c1-10(2)7-8-15-13-9-12-6-4-5-11(3)14-12/h4-6,9-10H,7-8H2,1-3H3/b13-9-
InChIKey
NDDRFVVJLAAPDP-LCYFTJDESA-N
Compound name
(Z)-N-(3-methylbutoxy)-1-(6-methyl-2-pyridinyl)methanimine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

206.1419 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.149176 148.0
[M+Na]+ 229.131118 154.8
[M-H]- 205.134624 151.4
[M+NH4]+ 224.175723 166.3
[M+K]+ 245.105058 153.3
[M+H-H2O]+ 189.139160 140.4
[M+HCOO]- 251.140101 172.3
[M+CH3COO]- 265.155751 192.9
[M+Na-2H]- 227.116566 153.6
[M]+ 206.14135142 151.1
[M]- 206.14244858 151.1
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.