CID 121237

Carbamic acid, diphenyldithio-, 2-(diethylamino)ethyl ester, phosphate

Structural Information

Molecular Formula
C19H24N2S2
SMILES
CCN(CC)CCSC(=S)N(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C19H24N2S2/c1-3-20(4-2)15-16-23-19(22)21(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14H,3-4,15-16H2,1-2H3
InChIKey
HPLQXTCMOVPQGT-UHFFFAOYSA-N
Compound name
2-(diethylamino)ethyl N,N-diphenylcarbamodithioate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

344.1381 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.14538 177.1
[M+Na]+ 367.12732 188.1
[M+NH4]+ 362.17192 186.4
[M+K]+ 383.10126 176.4
[M-H]- 343.13082 183.8
[M+Na-2H]- 365.11277 185.9
[M]+ 344.13755 181.6
[M]- 344.13865 181.6
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