CID 37910

Tolamolol

Structural Information

Molecular Formula
C19H24N2O4
SMILES
CC1=CC=CC=C1OCC(CNCCOC2=CC=C(C=C2)C(=O)N)O
InChI
InChI=1S/C19H24N2O4/c1-14-4-2-3-5-18(14)25-13-16(22)12-21-10-11-24-17-8-6-15(7-9-17)19(20)23/h2-9,16,21-22H,10-13H2,1H3,(H2,20,23)
InChIKey
SKQDKFOTIPJUSV-UHFFFAOYSA-N
Compound name
4-[2-[[2-hydroxy-3-(2-methylphenoxy)propyl]amino]ethoxy]benzamide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

22
References

1360
Patents

344.1736 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.18088 182.1
[M+Na]+ 367.16282 185.3
[M-H]- 343.16632 186.2
[M+NH4]+ 362.20742 193.2
[M+K]+ 383.13676 182.2
[M+H-H2O]+ 327.17086 172.9
[M+HCOO]- 389.17180 203.6
[M+CH3COO]- 403.18745 215.7
[M+Na-2H]- 365.14827 183.1
[M]+ 344.17305 183.1
[M]- 344.17415 183.1
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.