CID 950337

1-hydrazino-8-methoxy-3,4-dihydropyrazino(1,2-a)indole hydrochloride dihydrate

Structural Information

Molecular Formula
C12H14N4O
SMILES
COC1=CC2=C(C=C1)N3CCN=C(C3=C2)NN
InChI
InChI=1S/C12H14N4O/c1-17-9-2-3-10-8(6-9)7-11-12(15-13)14-4-5-16(10)11/h2-3,6-7H,4-5,13H2,1H3,(H,14,15)
InChIKey
LKTJJJNIKWTJAY-UHFFFAOYSA-N
Compound name
(8-methoxy-3,4-dihydropyrazino[1,2-a]indol-1-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

230.11676 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.124036 147.5
[M+Na]+ 253.105978 157.5
[M-H]- 229.109484 150.7
[M+NH4]+ 248.150583 166.5
[M+K]+ 269.079918 153.3
[M+H-H2O]+ 213.114020 139.8
[M+HCOO]- 275.114961 170.7
[M+CH3COO]- 289.130611 160.4
[M+Na-2H]- 251.091426 155.8
[M]+ 230.11621142 148.2
[M]- 230.11730858 148.2
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.