CID 283308

3-bromo-10h-phenothiazine

Structural Information

Molecular Formula
C12H8BrNS
SMILES
C1=CC=C2C(=C1)NC3=C(S2)C=C(C=C3)Br
InChI
InChI=1S/C12H8BrNS/c13-8-5-6-10-12(7-8)15-11-4-2-1-3-9(11)14-10/h1-7,14H
InChIKey
JEWIAYIESCUSKQ-UHFFFAOYSA-N
Compound name
3-bromo-10H-phenothiazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

131
Patents

276.9561 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.96338 136.9
[M+Na]+ 299.94532 143.0
[M+NH4]+ 294.98992 144.4
[M+K]+ 315.91926 139.6
[M-H]- 275.94882 139.6
[M+Na-2H]- 297.93077 142.3
[M]+ 276.95555 138.0
[M]- 276.95665 138.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe