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

0
Patents

248.15248 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.15976 156.2
[M+Na]+ 271.14170 160.8
[M-H]- 247.14520 159.4
[M+NH4]+ 266.18630 173.6
[M+K]+ 287.11564 158.0
[M+H-H2O]+ 231.14974 149.2
[M+HCOO]- 293.15068 177.1
[M+CH3COO]- 307.16633 200.3
[M+Na-2H]- 269.12715 160.2
[M]+ 248.15193 153.7
[M]- 248.15303 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