CID 135921580

2-iodometilato della 2-idrossiminometil-4-butilpiridina [italian]

Structural Information

Molecular Formula
C11H17N2O
SMILES
CCCCC1=CC(=[N+](C=C1)C)/C=N/O
InChI
InChI=1S/C11H16N2O/c1-3-4-5-10-6-7-13(2)11(8-10)9-12-14/h6-9H,3-5H2,1-2H3/p+1
InChIKey
QQJXMJLBICILHQ-UHFFFAOYSA-O
Compound name
(NE)-N-[(4-butyl-1-methylpyridin-1-ium-2-yl)methylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.1341 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.14138 143.8
[M+Na]+ 216.12332 151.8
[M-H]- 192.12682 146.6
[M+NH4]+ 211.16792 162.1
[M+K]+ 232.09726 143.7
[M+H-H2O]+ 176.13136 139.8
[M+HCOO]- 238.13230 167.7
[M+CH3COO]- 252.14795 180.7
[M+Na-2H]- 214.10877 152.3
[M]+ 193.13355 144.4
[M]- 193.13465 144.4
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.