CID 9038

152-18-1

Structural Information

Molecular Formula
C3H9O3PS
SMILES
COP(=S)(OC)OC
InChI
InChI=1S/C3H9O3PS/c1-4-7(8,5-2)6-3/h1-3H3
InChIKey
XWSLYQXUTWUIKM-UHFFFAOYSA-N
Compound name
trimethoxy(sulfanylidene)-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

16
References

534
Patents

156.001 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.008276 128.3
[M+Na]+ 178.990218 136.7
[M-H]- 154.993724 128.2
[M+NH4]+ 174.034823 150.6
[M+K]+ 194.964158 137.2
[M+H-H2O]+ 138.998260 121.7
[M+HCOO]- 200.999201 152.5
[M+CH3COO]- 215.014851 174.4
[M+Na-2H]- 176.975666 130.8
[M]+ 156.00045142 135.1
[M]- 156.00154858 135.1
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