CID 3131840

6-hydrazinyl-8-oxa-3,5-diazatricyclo[7.4.0.0,2,7]trideca-1(9),2(7),3,5,10,12-hexaene

Structural Information

Molecular Formula
C10H8N4O
SMILES
C1=CC=C2C(=C1)C3=C(O2)C(=NC=N3)NN
InChI
InChI=1S/C10H8N4O/c11-14-10-9-8(12-5-13-10)6-3-1-2-4-7(6)15-9/h1-5H,11H2,(H,12,13,14)
InChIKey
DMWZPKRPLIZDNL-UHFFFAOYSA-N
Compound name
[1]benzofuro[3,2-d]pyrimidin-4-ylhydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

1
Patents

200.06981 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.07709 136.9
[M+Na]+ 223.05903 148.1
[M-H]- 199.06253 141.1
[M+NH4]+ 218.10363 155.6
[M+K]+ 239.03297 145.0
[M+H-H2O]+ 183.06707 129.4
[M+HCOO]- 245.06801 161.3
[M+CH3COO]- 259.08366 151.0
[M+Na-2H]- 221.04448 148.5
[M]+ 200.06926 138.7
[M]- 200.07036 138.7
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