CID 78038

3360 rp

Structural Information

Molecular Formula
C19H24N2S
SMILES
CC(C)(CN1C2=CC=CC=C2SC3=CC=CC=C31)CN(C)C
InChI
InChI=1S/C19H24N2S/c1-19(2,13-20(3)4)14-21-15-9-5-7-11-17(15)22-18-12-8-6-10-16(18)21/h5-12H,13-14H2,1-4H3
InChIKey
KYNBTEGMZBRGSV-UHFFFAOYSA-N
Compound name
N,N,2,2-tetramethyl-3-phenothiazin-10-ylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

312.16602 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.17330 174.0
[M+Na]+ 335.15524 187.6
[M+NH4]+ 330.19984 184.2
[M+K]+ 351.12918 177.0
[M-H]- 311.15874 178.7
[M+Na-2H]- 333.14069 181.0
[M]+ 312.16547 178.1
[M]- 312.16657 178.1
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.