CID 3410

Formoterol

Structural Information

Molecular Formula

C₁₉H₂₄N₂O₄

SMILES

CC(CC1=CC=C(C=C1)OC)NCC(C2=CC(=C(C=C2)O)NC=O)O

InChI

InChI=1S/C19H24N2O4/c1-13(9-14-3-6-16(25-2)7-4-14)20-11-19(24)15-5-8-18(23)17(10-15)21-12-22/h3-8,10,12-13,19-20,23-24H,9,11H2,1-2H3,(H,21,22)

InChIKey

BPZSYCZIITTYBL-UHFFFAOYSA-N

Compound name

N-[2-hydroxy-5-[1-hydroxy-2-[1-(4-methoxyphenyl)propan-2-ylamino]ethyl]phenyl]formamide

Related CIDs

2D Structure

compound 2d structure

7
Annotation Hits: 2706
References: 51606
Patents: 344.1736 Da
Monoisotopic Mass: 1.8
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]+	345.18088	183.9
[M+Na]+	367.16282	193.6
[M+NH4]+	362.20742	189.0
[M+K]+	383.13676	188.3
[M-H]-	343.16632	186.7
[M+Na-2H]-	365.14827	189.0
[M]+	344.17305	185.7
[M]-	344.17415	185.7

Literature stripe

literature stripe

Patent stripe

patents stripe