CID 2834364

67193-95-7

Structural Information

Molecular Formula
C14H23NO2
SMILES
CCC1=CC=C(C=C1)OCC(CNC(C)C)O
InChI
InChI=1S/C14H23NO2/c1-4-12-5-7-14(8-6-12)17-10-13(16)9-15-11(2)3/h5-8,11,13,15-16H,4,9-10H2,1-3H3
InChIKey
OMSWREDBGOSTLF-UHFFFAOYSA-N
Compound name
1-(4-ethylphenoxy)-3-(propan-2-ylamino)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

62
Patents

237.17288 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.18016 157.9
[M+Na]+ 260.16210 167.8
[M+NH4]+ 255.20670 165.0
[M+K]+ 276.13604 162.0
[M-H]- 236.16560 159.5
[M+Na-2H]- 258.14755 162.5
[M]+ 237.17233 159.5
[M]- 237.17343 159.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe