CID 43910

Benzenemethanol, alpha-((ethylamino)methyl)-3-(trifluoromethyl)-, hydrochloride

Structural Information

Molecular Formula
C11H14F3NO
SMILES
CCNCC(C1=CC(=CC=C1)C(F)(F)F)O
InChI
InChI=1S/C11H14F3NO/c1-2-15-7-10(16)8-4-3-5-9(6-8)11(12,13)14/h3-6,10,15-16H,2,7H2,1H3
InChIKey
YTKDUDMDCXIKLL-UHFFFAOYSA-N
Compound name
2-(ethylamino)-1-[3-(trifluoromethyl)phenyl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.10275 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.11003 153.3
[M+Na]+ 256.09197 160.8
[M+NH4]+ 251.13657 158.4
[M+K]+ 272.06591 156.0
[M-H]- 232.09547 150.2
[M+Na-2H]- 254.07742 156.6
[M]+ 233.10220 153.1
[M]- 233.10330 153.1
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.