CID 15346092

Dtxsid201028380

Structural Information

Molecular Formula
C14H23NO2
SMILES
CCOC1=C(C=CC(=C1)C(C)(C)C)C(CO)N
InChI
InChI=1S/C14H23NO2/c1-5-17-13-8-10(14(2,3)4)6-7-11(13)12(15)9-16/h6-8,12,16H,5,9,15H2,1-4H3
InChIKey
LOGSAUNKXYILQB-UHFFFAOYSA-N
Compound name
2-amino-2-(4-tert-butyl-2-ethoxyphenyl)ethanol
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

1
References

8
Patents

237.17288 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.18016 158.2
[M+Na]+ 260.16210 164.2
[M-H]- 236.16560 160.0
[M+NH4]+ 255.20670 175.3
[M+K]+ 276.13604 161.9
[M+H-H2O]+ 220.17014 152.5
[M+HCOO]- 282.17108 177.9
[M+CH3COO]- 296.18673 195.0
[M+Na-2H]- 258.14755 160.5
[M]+ 237.17233 158.7
[M]- 237.17343 158.7
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.