CID 3438663

90237-32-4

Structural Information

Molecular Formula
C14H18N2
SMILES
CC1C2=C(C3=C(N2CCN1)C=CC(=C3)C)C
InChI
InChI=1S/C14H18N2/c1-9-4-5-13-12(8-9)10(2)14-11(3)15-6-7-16(13)14/h4-5,8,11,15H,6-7H2,1-3H3
InChIKey
UVXUELUMSMKCIT-UHFFFAOYSA-N
Compound name
1,8,10-trimethyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.147 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.15428 149.8
[M+Na]+ 237.13622 160.2
[M-H]- 213.13972 151.8
[M+NH4]+ 232.18082 170.0
[M+K]+ 253.11016 154.6
[M+H-H2O]+ 197.14426 142.9
[M+HCOO]- 259.14520 167.6
[M+CH3COO]- 273.16085 162.3
[M+Na-2H]- 235.12167 154.2
[M]+ 214.14645 149.1
[M]- 214.14755 149.1
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.