CID 135926961

Pyridinium, 4-formyl-1-(3-(triethylammonio)propyl)-, dibromide, oxime

Structural Information

Molecular Formula
C15H27N3O
SMILES
CC[N+](CC)(CC)CCC[N+]1=CC=C(C=C1)/C=N/O
InChI
InChI=1S/C15H26N3O/c1-4-18(5-2,6-3)13-7-10-17-11-8-15(9-12-17)14-16-19/h8-9,11-12,14H,4-7,10,13H2,1-3H3/q+1/p+1
InChIKey
QUOGHPPVIHDBIH-UHFFFAOYSA-O
Compound name
triethyl-[3-[4-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]propyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.21542 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.222696 163.7
[M+Na]+ 288.204638 168.7
[M-H]- 264.208144 167.1
[M+NH4]+ 283.249243 178.9
[M+K]+ 304.178578 155.3
[M+H-H2O]+ 248.212680 161.4
[M+HCOO]- 310.213621 186.3
[M+CH3COO]- 324.229271 193.6
[M+Na-2H]- 286.190086 174.8
[M]+ 265.21487142 164.2
[M]- 265.21596858 164.2
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.