CID 6410522

10h-pyridazino(4,5-b)(1,4)benzoxazine-10-propanamine, 1-butoxy-n,n-dimethyl-, hydrochloride, hydrate (2:4:1)

Structural Information

Molecular Formula
C19H26N4O2
SMILES
CCCCOC1=C2C(=CN=N1)OC3=CC=CC=C3N2CCCN(C)C
InChI
InChI=1S/C19H26N4O2/c1-4-5-13-24-19-18-17(14-20-21-19)25-16-10-7-6-9-15(16)23(18)12-8-11-22(2)3/h6-7,9-10,14H,4-5,8,11-13H2,1-3H3
InChIKey
GAKJMTMIYBCRPV-UHFFFAOYSA-N
Compound name
3-(1-butoxypyridazino[4,5-b][1,4]benzoxazin-10-yl)-N,N-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.20557 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.21285 185.2
[M+Na]+ 365.19479 199.0
[M+NH4]+ 360.23939 192.2
[M+K]+ 381.16873 191.1
[M-H]- 341.19829 189.0
[M+Na-2H]- 363.18024 189.7
[M]+ 342.20502 188.3
[M]- 342.20612 188.3
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.