CID 3071651

138112-98-8

Structural Information

Molecular Formula
C15H18N2O2
SMILES
COC1=CC2=C(C=CC=C2CCNC(=O)CN)C=C1
InChI
InChI=1S/C15H18N2O2/c1-19-13-6-5-11-3-2-4-12(14(11)9-13)7-8-17-15(18)10-16/h2-6,9H,7-8,10,16H2,1H3,(H,17,18)
InChIKey
WJRZIBXQDYOZSD-UHFFFAOYSA-N
Compound name
2-amino-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

258.13684 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.14412 158.9
[M+Na]+ 281.12606 165.2
[M-H]- 257.12956 162.7
[M+NH4]+ 276.17066 176.1
[M+K]+ 297.10000 161.7
[M+H-H2O]+ 241.13410 151.6
[M+HCOO]- 303.13504 182.3
[M+CH3COO]- 317.15069 201.9
[M+Na-2H]- 279.11151 164.2
[M]+ 258.13629 159.5
[M]- 258.13739 159.5
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