CID 3063105

Thioxanthene-9,9-bis(methylamine), n,n,n',n'-tetramethyl-, dihydrochloride

Structural Information

Molecular Formula
C19H24N2S
SMILES
CN(C)CC1(C2=CC=CC=C2SC3=CC=CC=C31)CN(C)C
InChI
InChI=1S/C19H24N2S/c1-20(2)13-19(14-21(3)4)15-9-5-7-11-17(15)22-18-12-8-6-10-16(18)19/h5-12H,13-14H2,1-4H3
InChIKey
XIDIIRGFFZEMLZ-UHFFFAOYSA-N
Compound name
1-[9-[(dimethylamino)methyl]thioxanthen-9-yl]-N,N-dimethylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.16602 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.17330 172.0
[M+Na]+ 335.15524 185.1
[M+NH4]+ 330.19984 184.4
[M+K]+ 351.12918 172.4
[M-H]- 311.15874 178.5
[M+Na-2H]- 333.14069 181.1
[M]+ 312.16547 176.6
[M]- 312.16657 176.6
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.