CID 3051867

Benzamide, n-benzyl-p-methyl-thio-

Structural Information

Molecular Formula
C15H15NS
SMILES
CC1=CC=C(C=C1)C(=S)NCC2=CC=CC=C2
InChI
InChI=1S/C15H15NS/c1-12-7-9-14(10-8-12)15(17)16-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,16,17)
InChIKey
CWVFISVRIFNCRY-UHFFFAOYSA-N
Compound name
N-benzyl-4-methylbenzenecarbothioamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

241.09251 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.09979 154.2
[M+Na]+ 264.08173 168.3
[M+NH4]+ 259.12633 164.2
[M+K]+ 280.05567 157.6
[M-H]- 240.08523 160.4
[M+Na-2H]- 262.06718 164.1
[M]+ 241.09196 158.6
[M]- 241.09306 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

patents stripe