CID 3055305

1-(2-(6-methoxy-2-naphthalenyl)propyl)piperazine dihydrochloride

Structural Information

Molecular Formula
C18H24N2O
SMILES
CC(CN1CCNCC1)C2=CC3=C(C=C2)C=C(C=C3)OC
InChI
InChI=1S/C18H24N2O/c1-14(13-20-9-7-19-8-10-20)15-3-4-17-12-18(21-2)6-5-16(17)11-15/h3-6,11-12,14,19H,7-10,13H2,1-2H3
InChIKey
DGFACWGEXUATRT-UHFFFAOYSA-N
Compound name
1-[2-(6-methoxynaphthalen-2-yl)propyl]piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

284.18887 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.19615 170.0
[M+Na]+ 307.17809 174.2
[M-H]- 283.18159 172.0
[M+NH4]+ 302.22269 182.8
[M+K]+ 323.15203 168.9
[M+H-H2O]+ 267.18613 160.3
[M+HCOO]- 329.18707 183.4
[M+CH3COO]- 343.20272 178.6
[M+Na-2H]- 305.16354 172.9
[M]+ 284.18832 165.5
[M]- 284.18942 165.5
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