CID 214806

8-methoxy-1,10-trimethylene-pyrazino-indole hydrochloride

Structural Information

Molecular Formula
C15H18N2O
SMILES
COC1=CC2=C(C=C1)N3CCNC4C3=C2CCC4
InChI
InChI=1S/C15H18N2O/c1-18-10-5-6-14-12(9-10)11-3-2-4-13-15(11)17(14)8-7-16-13/h5-6,9,13,16H,2-4,7-8H2,1H3
InChIKey
NJXIYXLRLVISPD-UHFFFAOYSA-N
Compound name
12-methoxy-1,4-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10(15),11,13-tetraene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

0
Patents

242.1419 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.14918 154.4
[M+Na]+ 265.13112 162.3
[M-H]- 241.13462 155.5
[M+NH4]+ 260.17572 173.7
[M+K]+ 281.10506 156.7
[M+H-H2O]+ 225.13916 146.4
[M+HCOO]- 287.14010 168.8
[M+CH3COO]- 301.15575 165.3
[M+Na-2H]- 263.11657 160.1
[M]+ 242.14135 152.6
[M]- 242.14245 152.6
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

No patent data available for this compound.