CID 214832

34352-60-8

Structural Information

Molecular Formula
C15H17N5O
SMILES
CN1C2=CC=CC=C2OC3=NN=C(C=C31)N4CCNCC4
InChI
InChI=1S/C15H17N5O/c1-19-11-4-2-3-5-13(11)21-15-12(19)10-14(17-18-15)20-8-6-16-7-9-20/h2-5,10,16H,6-9H2,1H3
InChIKey
KMKHHMJOWLXRHH-UHFFFAOYSA-N
Compound name
5-methyl-3-piperazin-1-ylpyridazino[3,4-b][1,4]benzoxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.1433 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.15058 169.6
[M+Na]+ 306.13252 184.9
[M+NH4]+ 301.17712 177.0
[M+K]+ 322.10646 177.5
[M-H]- 282.13602 173.4
[M+Na-2H]- 304.11797 175.2
[M]+ 283.14275 172.8
[M]- 283.14385 172.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.