CID 164405

N-cyclopropylcarbonyl-2-(7-methoxy-1-naphthyl)ethylamine

Structural Information

Molecular Formula
C17H19NO2
SMILES
COC1=CC2=C(C=CC=C2CCNC(=O)C3CC3)C=C1
InChI
InChI=1S/C17H19NO2/c1-20-15-8-7-12-3-2-4-13(16(12)11-15)9-10-18-17(19)14-5-6-14/h2-4,7-8,11,14H,5-6,9-10H2,1H3,(H,18,19)
InChIKey
TZQAGPUEZZMDSL-UHFFFAOYSA-N
Compound name
N-[2-(7-methoxynaphthalen-1-yl)ethyl]cyclopropanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

99
Patents

269.14157 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.148846 159.7
[M+Na]+ 292.130788 167.9
[M-H]- 268.134294 167.7
[M+NH4]+ 287.175393 172.2
[M+K]+ 308.104728 163.4
[M+H-H2O]+ 252.138830 152.3
[M+HCOO]- 314.139771 182.6
[M+CH3COO]- 328.155421 204.3
[M+Na-2H]- 290.116236 165.2
[M]+ 269.14102142 163.8
[M]- 269.14211858 163.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe