CID 134700

Punky blue

Structural Information

Molecular Formula
C15H15N3O
SMILES
CCN=C1C=C2C(=NC3=C(O2)C=C(C=C3)N)C=C1C
InChI
InChI=1S/C15H15N3O/c1-3-17-12-8-15-13(6-9(12)2)18-11-5-4-10(16)7-14(11)19-15/h4-8H,3,16H2,1-2H3
InChIKey
QVCZODSSCZARDB-UHFFFAOYSA-N
Compound name
7-ethylimino-8-methylphenoxazin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

5
Patents

253.1215 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.128776 157.5
[M+Na]+ 276.110718 168.2
[M-H]- 252.114224 163.9
[M+NH4]+ 271.155323 174.6
[M+K]+ 292.084658 164.5
[M+H-H2O]+ 236.118760 149.1
[M+HCOO]- 298.119701 180.7
[M+CH3COO]- 312.135351 170.6
[M+Na-2H]- 274.096166 166.8
[M]+ 253.12095142 159.9
[M]- 253.12204858 159.9
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.