CID 6504231

883546-13-2

Structural Information

Molecular Formula

C₁₄H₁₉NO₄

SMILES

COC1=CC=CC(=C1OCCN2CCOCC2)C=O

InChI

InChI=1S/C14H19NO4/c1-17-13-4-2-3-12(11-16)14(13)19-10-7-15-5-8-18-9-6-15/h2-4,11H,5-10H2,1H3

InChIKey

WWOLOKZLMZZKJY-UHFFFAOYSA-N

Compound name

3-methoxy-2-(2-morpholin-4-ylethoxy)benzaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 265.1314 Da
Monoisotopic Mass: 1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	266.13868	160.0
[M+Na]+	288.12062	165.5
[M-H]-	264.12412	165.1
[M+NH4]+	283.16522	173.5
[M+K]+	304.09456	164.7
[M+H-H2O]+	248.12866	151.3
[M+HCOO]-	310.12960	178.9
[M+CH3COO]-	324.14525	195.4
[M+Na-2H]-	286.10607	164.6
[M]+	265.13085	161.7
[M]-	265.13195	161.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe