CID 3053529

Tyramine, n-phenethyl-n-propyl-, hydrochloride

Structural Information

Molecular Formula
C19H25NO
SMILES
CCCN(CCC1=CC=CC=C1)CCC2=CC=C(C=C2)O
InChI
InChI=1S/C19H25NO/c1-2-14-20(15-12-17-6-4-3-5-7-17)16-13-18-8-10-19(21)11-9-18/h3-11,21H,2,12-16H2,1H3
InChIKey
ZMMHMRRGUZWVKQ-UHFFFAOYSA-N
Compound name
4-[2-[2-phenylethyl(propyl)amino]ethyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.1936 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.20088 171.3
[M+Na]+ 306.18282 184.6
[M+NH4]+ 301.22742 180.0
[M+K]+ 322.15676 175.4
[M-H]- 282.18632 176.9
[M+Na-2H]- 304.16827 180.4
[M]+ 283.19305 174.9
[M]- 283.19415 174.9
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.