CID 154449

138768-62-4

Structural Information

Molecular Formula

C₁₅H₂₄N₂O₄

SMILES

CC(C)N(CC(COC1=CC=C(C=C1)CCOC)O)N=O

InChI

InChI=1S/C15H24N2O4/c1-12(2)17(16-19)10-14(18)11-21-15-6-4-13(5-7-15)8-9-20-3/h4-7,12,14,18H,8-11H2,1-3H3

InChIKey

CHTOBGHTYDROBB-UHFFFAOYSA-N

Compound name

N-[2-hydroxy-3-[4-(2-methoxyethyl)phenoxy]propyl]-N-propan-2-ylnitrous amide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 4
Patents: 296.1736 Da
Monoisotopic Mass: 2.2
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]+	297.180876	170.9
[M+Na]+	319.162818	174.4
[M-H]-	295.166324	175.1
[M+NH4]+	314.207423	185.9
[M+K]+	335.136758	175.1
[M+H-H2O]+	279.170860	162.6
[M+HCOO]-	341.171801	195.1
[M+CH3COO]-	355.187451	212.9
[M+Na-2H]-	317.148266	172.7
[M]+	296.17305142	176.9
[M]-	296.17414858	176.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe