CID 3051605

3-(6-methoxy-1,2,3,4-tetrahydro-1-naphthylamino)propionamide hydrochloride

Structural Information

Molecular Formula
C14H20N2O2
SMILES
COC1=CC2=C(C=C1)C(CCC2)NCCC(=O)N
InChI
InChI=1S/C14H20N2O2/c1-18-11-5-6-12-10(9-11)3-2-4-13(12)16-8-7-14(15)17/h5-6,9,13,16H,2-4,7-8H2,1H3,(H2,15,17)
InChIKey
FKGKOECHTPVTHB-UHFFFAOYSA-N
Compound name
3-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

248.15248 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.159756 156.2
[M+Na]+ 271.141698 160.8
[M-H]- 247.145204 159.4
[M+NH4]+ 266.186303 173.6
[M+K]+ 287.115638 158.0
[M+H-H2O]+ 231.149740 149.2
[M+HCOO]- 293.150681 177.1
[M+CH3COO]- 307.166331 200.3
[M+Na-2H]- 269.127146 160.2
[M]+ 248.15193142 153.7
[M]- 248.15302858 153.7
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

patents stripe