CID 11820870

Benzaldehyde, 3-[2-[1-(6-methyl-3-pyridazinyl)-4-piperidinyl]ethoxy]-, o-methyloxime

Structural Information

Molecular Formula
C20H26N4O2
SMILES
CC1=NN=C(C=C1)N2CCC(CC2)CCOC3=CC=CC(=C3)/C=N/OC
InChI
InChI=1S/C20H26N4O2/c1-16-6-7-20(23-22-16)24-11-8-17(9-12-24)10-13-26-19-5-3-4-18(14-19)15-21-25-2/h3-7,14-15,17H,8-13H2,1-2H3/b21-15+
InChIKey
RQGXUVQLTOPSPU-RCCKNPSSSA-N
Compound name
(E)-N-methoxy-1-[3-[2-[1-(6-methylpyridazin-3-yl)piperidin-4-yl]ethoxy]phenyl]methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.20557 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.21285 187.9
[M+Na]+ 377.19479 192.4
[M-H]- 353.19829 193.5
[M+NH4]+ 372.23939 196.3
[M+K]+ 393.16873 187.6
[M+H-H2O]+ 337.20283 174.9
[M+HCOO]- 399.20377 206.1
[M+CH3COO]- 413.21942 218.4
[M+Na-2H]- 375.18024 191.0
[M]+ 354.20502 187.7
[M]- 354.20612 187.7
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

No patent data available for this compound.