CID 9813758

547757-23-3

Structural Information

Molecular Formula
C14H17N5
SMILES
CC1=CC2=C(C=C1)N=C(C3=NC=C(N23)C)NCCN
InChI
InChI=1S/C14H17N5/c1-9-3-4-11-12(7-9)19-10(2)8-17-14(19)13(18-11)16-6-5-15/h3-4,7-8H,5-6,15H2,1-2H3,(H,16,18)
InChIKey
PSPFQEBFYXJZEV-UHFFFAOYSA-N
Compound name
N'-(1,8-dimethylimidazo[1,2-a]quinoxalin-4-yl)ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

124
References

1301
Patents

255.14839 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.15567 158.8
[M+Na]+ 278.13761 170.0
[M-H]- 254.14111 161.0
[M+NH4]+ 273.18221 175.8
[M+K]+ 294.11155 164.2
[M+H-H2O]+ 238.14565 150.2
[M+HCOO]- 300.14659 181.1
[M+CH3COO]- 314.16224 170.9
[M+Na-2H]- 276.12306 166.0
[M]+ 255.14784 161.2
[M]- 255.14894 161.2
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

patents stripe