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]+ 231.12404 147.5
[M+Na]+ 253.10598 157.5
[M-H]- 229.10948 150.7
[M+NH4]+ 248.15058 166.5
[M+K]+ 269.07992 153.3
[M+H-H2O]+ 213.11402 139.8
[M+HCOO]- 275.11496 170.7
[M+CH3COO]- 289.13061 160.4
[M+Na-2H]- 251.09143 155.8
[M]+ 230.11621 148.2
[M]- 230.11731 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.