CID 75878

2667-52-9

Structural Information

Molecular Formula
C10H23O2PS3
SMILES
CC(C)OP(=S)(OC(C)C)SCSC(C)C
InChI
InChI=1S/C10H23O2PS3/c1-8(2)11-13(14,12-9(3)4)16-7-15-10(5)6/h8-10H,7H2,1-6H3
InChIKey
CWEJGTFQSUAXKF-UHFFFAOYSA-N
Compound name
di(propan-2-yloxy)-(propan-2-ylsulfanylmethylsulfanyl)-sulfanylidene-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

302.05978 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.06706 161.8
[M+Na]+ 325.04900 165.1
[M-H]- 301.05250 159.2
[M+NH4]+ 320.09360 177.2
[M+K]+ 341.02294 161.0
[M+H-H2O]+ 285.05704 152.7
[M+HCOO]- 347.05798 168.7
[M+CH3COO]- 361.07363 205.4
[M+Na-2H]- 323.03445 155.5
[M]+ 302.05923 166.6
[M]- 302.06033 166.6
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