CID 2063907

677326-80-6

Structural Information

Molecular Formula
C16H20N2
SMILES
CC1=C(C2=CC=CC=C2C=C1)CN3CCNCC3
InChI
InChI=1S/C16H20N2/c1-13-6-7-14-4-2-3-5-15(14)16(13)12-18-10-8-17-9-11-18/h2-7,17H,8-12H2,1H3
InChIKey
DFWSIPPWIKEQII-UHFFFAOYSA-N
Compound name
1-[(2-methylnaphthalen-1-yl)methyl]piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.16264 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.169916 157.7
[M+Na]+ 263.151858 163.3
[M-H]- 239.155364 160.0
[M+NH4]+ 258.196463 172.6
[M+K]+ 279.125798 157.3
[M+H-H2O]+ 223.159900 148.4
[M+HCOO]- 285.160841 172.7
[M+CH3COO]- 299.176491 167.5
[M+Na-2H]- 261.137306 162.9
[M]+ 240.16209142 151.7
[M]- 240.16318858 151.7
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

No patent data available for this compound.