CID 3056092

73425-54-4

Structural Information

Molecular Formula
C19H20N2S
SMILES
C1CC(C2=C(C1)NC3=CC=CC=C32)CNSC4=CC=CC=C4
InChI
InChI=1S/C19H20N2S/c1-2-8-15(9-3-1)22-20-13-14-7-6-12-18-19(14)16-10-4-5-11-17(16)21-18/h1-5,8-11,14,20-21H,6-7,12-13H2
InChIKey
UIMLLOOLRJQOIU-UHFFFAOYSA-N
Compound name
N-phenylsulfanyl-1-(2,3,4,9-tetrahydro-1H-carbazol-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

308.1347 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.14198 168.7
[M+Na]+ 331.12392 183.0
[M+NH4]+ 326.16852 179.5
[M+K]+ 347.09786 172.9
[M-H]- 307.12742 175.1
[M+Na-2H]- 329.10937 177.0
[M]+ 308.13415 173.2
[M]- 308.13525 173.2
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.