CID 55275370

5-[(1r)-1-aminoethyl]-2-methylanilinehydrochloride

Structural Information

Molecular Formula
C9H14N2
SMILES
CC1=C(C=C(C=C1)[C@@H](C)N)N
InChI
InChI=1S/C9H14N2/c1-6-3-4-8(7(2)10)5-9(6)11/h3-5,7H,10-11H2,1-2H3/t7-/m1/s1
InChIKey
OYVZYIJAXIICPA-SSDOTTSWSA-N
Compound name
5-[(1R)-1-aminoethyl]-2-methylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

150.11569 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.12297 132.7
[M+Na]+ 173.10491 143.9
[M+NH4]+ 168.14951 141.4
[M+K]+ 189.07885 138.3
[M-H]- 149.10841 136.1
[M+Na-2H]- 171.09036 139.0
[M]+ 150.11514 135.1
[M]- 150.11624 135.1
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.