CID 688384

100900-10-5

Structural Information

Molecular Formula
C14H16N2O2
SMILES
COC1=CC(=CC2=CC=CC=C21)NC(=O)CCN
InChI
InChI=1S/C14H16N2O2/c1-18-13-9-11(16-14(17)6-7-15)8-10-4-2-3-5-12(10)13/h2-5,8-9H,6-7,15H2,1H3,(H,16,17)
InChIKey
NUOJRXOHKAOEDJ-UHFFFAOYSA-N
Compound name
3-amino-N-(4-methoxynaphthalen-2-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

244.12119 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.128466 154.3
[M+Na]+ 267.110408 161.0
[M-H]- 243.113914 158.3
[M+NH4]+ 262.155013 172.0
[M+K]+ 283.084348 157.8
[M+H-H2O]+ 227.118450 147.2
[M+HCOO]- 289.119391 178.1
[M+CH3COO]- 303.135041 198.9
[M+Na-2H]- 265.095856 160.2
[M]+ 244.12064142 154.5
[M]- 244.12173858 154.5
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