CID 117355

21535-56-8

Structural Information

Molecular Formula
C12H16N2
SMILES
C1CC2=CC=CC=C2N3C1CNCC3
InChI
InChI=1S/C12H16N2/c1-2-4-12-10(3-1)5-6-11-9-13-7-8-14(11)12/h1-4,11,13H,5-9H2
InChIKey
CHIINPDGHUONJZ-UHFFFAOYSA-N
Compound name
2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

98
Patents

188.13135 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.13863 143.2
[M+Na]+ 211.12057 156.3
[M+NH4]+ 206.16517 153.4
[M+K]+ 227.09451 148.1
[M-H]- 187.12407 146.0
[M+Na-2H]- 209.10602 148.8
[M]+ 188.13080 145.8
[M]- 188.13190 145.8
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