CID 105806

67846-56-4

Structural Information

Molecular Formula
C15H16N3O2
SMILES
C[N+](=C1C=CC2=NC3=C(C=C(C(=C3)OC)N)OC2=C1)C
InChI
InChI=1S/C15H15N3O2/c1-18(2)9-4-5-11-14(6-9)20-15-7-10(16)13(19-3)8-12(15)17-11/h4-8,16H,1-3H3/p+1
InChIKey
MTUGFHRBKVEJRG-UHFFFAOYSA-O
Compound name
(7-amino-8-methoxyphenoxazin-3-ylidene)-dimethylazanium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

25
Patents

270.12424 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.13152 161.4
[M+Na]+ 293.11346 171.1
[M-H]- 269.11696 168.1
[M+NH4]+ 288.15806 177.3
[M+K]+ 309.08740 163.1
[M+H-H2O]+ 253.12150 155.6
[M+HCOO]- 315.12244 183.4
[M+CH3COO]- 329.13809 200.4
[M+Na-2H]- 291.09891 172.0
[M]+ 270.12369 163.3
[M]- 270.12479 163.3
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

patents stripe