CID 3046520

62246-71-3

Structural Information

Molecular Formula
C16H19O2PS
SMILES
CCOP(=S)(C)OC(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C16H19O2PS/c1-3-17-19(2,20)18-16(14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4-13,16H,3H2,1-2H3
InChIKey
DSGQGNTUWZWMOH-UHFFFAOYSA-N
Compound name
benzhydryloxy-ethoxy-methyl-sulfanylidene-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.08435 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.09163 170.4
[M+Na]+ 329.07357 175.9
[M-H]- 305.07707 175.5
[M+NH4]+ 324.11817 185.9
[M+K]+ 345.04751 172.1
[M+H-H2O]+ 289.08161 160.3
[M+HCOO]- 351.08255 192.5
[M+CH3COO]- 365.09820 203.1
[M+Na-2H]- 327.05902 170.1
[M]+ 306.08380 174.2
[M]- 306.08490 174.2
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

No patent data available for this compound.