CID 75641

Dicyclohexyldithiophosphinic acid

Structural Information

Molecular Formula
C12H23PS2
SMILES
C1CCC(CC1)P(=S)(C2CCCCC2)S
InChI
InChI=1S/C12H23PS2/c14-13(15,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h11-12H,1-10H2,(H,14,15)
InChIKey
TYWAKIKWTGMYJY-UHFFFAOYSA-N
Compound name
dicyclohexyl-sulfanyl-sulfanylidene-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

78
Patents

262.09787 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.10515 154.0
[M+Na]+ 285.08709 155.9
[M-H]- 261.09059 157.0
[M+NH4]+ 280.13169 171.3
[M+K]+ 301.06103 151.8
[M+H-H2O]+ 245.09513 145.3
[M+HCOO]- 307.09607 164.6
[M+CH3COO]- 321.11172 193.2
[M+Na-2H]- 283.07254 149.8
[M]+ 262.09732 147.1
[M]- 262.09842 147.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe