CID 9588752

139886-14-9

Structural Information

Molecular Formula
C14H18N2O
SMILES
CO/N=C/C1=CCCN(C1)CC2=CC=CC=C2
InChI
InChI=1S/C14H18N2O/c1-17-15-10-14-8-5-9-16(12-14)11-13-6-3-2-4-7-13/h2-4,6-8,10H,5,9,11-12H2,1H3/b15-10+
InChIKey
FGFORGFBAYWMRX-XNTDXEJSSA-N
Compound name
(E)-1-(1-benzyl-3,6-dihydro-2H-pyridin-5-yl)-N-methoxymethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

230.1419 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.149176 152.8
[M+Na]+ 253.131118 158.2
[M-H]- 229.134624 158.6
[M+NH4]+ 248.175723 169.5
[M+K]+ 269.105058 155.3
[M+H-H2O]+ 213.139160 143.8
[M+HCOO]- 275.140101 176.0
[M+CH3COO]- 289.155751 194.4
[M+Na-2H]- 251.116566 159.1
[M]+ 230.14135142 151.7
[M]- 230.14244858 151.7
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

patents stripe