CID 95203

10-phenylphenothiazine

Structural Information

Molecular Formula
C18H13NS
SMILES
C1=CC=C(C=C1)N2C3=CC=CC=C3SC4=CC=CC=C42
InChI
InChI=1S/C18H13NS/c1-2-8-14(9-3-1)19-15-10-4-6-12-17(15)20-18-13-7-5-11-16(18)19/h1-13H
InChIKey
WSEFYHOJDVVORU-UHFFFAOYSA-N
Compound name
10-phenylphenothiazine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

877
Patents

275.07687 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.08415 158.5
[M+Na]+ 298.06609 167.7
[M-H]- 274.06959 165.4
[M+NH4]+ 293.11069 175.7
[M+K]+ 314.04003 160.8
[M+H-H2O]+ 258.07413 150.1
[M+HCOO]- 320.07507 173.6
[M+CH3COO]- 334.09072 170.2
[M+Na-2H]- 296.05154 165.8
[M]+ 275.07632 158.6
[M]- 275.07742 158.6
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.