CID 9588770

139886-26-3

Structural Information

Molecular Formula
C11H18N2O
SMILES
C/C=C/CO/N=C/C1=CCCN(C1)C
InChI
InChI=1S/C11H18N2O/c1-3-4-8-14-12-9-11-6-5-7-13(2)10-11/h3-4,6,9H,5,7-8,10H2,1-2H3/b4-3+,12-9+
InChIKey
DNJGRYMUXBTFOE-GMHKHPCXSA-N
Compound name
(E)-N-[(E)-but-2-enoxy]-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.1419 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.149176 145.2
[M+Na]+ 217.131118 150.9
[M-H]- 193.134624 147.9
[M+NH4]+ 212.175723 163.8
[M+K]+ 233.105058 149.0
[M+H-H2O]+ 177.139160 137.8
[M+HCOO]- 239.140101 168.1
[M+CH3COO]- 253.155751 188.3
[M+Na-2H]- 215.116566 150.5
[M]+ 194.14135142 144.9
[M]- 194.14244858 144.9
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.