CID 2760172

1-(naphthalen-2-yl)piperazine

Structural Information

Molecular Formula
C14H16N2
SMILES
C1CN(CCN1)C2=CC3=CC=CC=C3C=C2
InChI
InChI=1S/C14H16N2/c1-2-4-13-11-14(6-5-12(13)3-1)16-9-7-15-8-10-16/h1-6,11,15H,7-10H2
InChIKey
LWLBVIFUVSUSAY-UHFFFAOYSA-N
Compound name
1-naphthalen-2-ylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

219
Patents

212.13135 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.138626 148.2
[M+Na]+ 235.120568 153.6
[M-H]- 211.124074 150.5
[M+NH4]+ 230.165173 163.8
[M+K]+ 251.094508 148.1
[M+H-H2O]+ 195.128610 139.1
[M+HCOO]- 257.129551 163.8
[M+CH3COO]- 271.145201 158.5
[M+Na-2H]- 233.106016 155.2
[M]+ 212.13080142 141.1
[M]- 212.13189858 141.1
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