CID 90710

Brn 3064728

Structural Information

Molecular Formula
C11H27NO6P2S
SMILES
CC(C)OP(=O)(N(C)CCSP(=O)(OC)OC)OC(C)C
InChI
InChI=1S/C11H27NO6P2S/c1-10(2)17-19(13,18-11(3)4)12(5)8-9-21-20(14,15-6)16-7/h10-11H,8-9H2,1-7H3
InChIKey
IMSAFKDAGZMSMJ-UHFFFAOYSA-N
Compound name
2-dimethoxyphosphorylsulfanyl-N-di(propan-2-yloxy)phosphoryl-N-methylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

363.10342 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.11070 180.2
[M+Na]+ 386.09264 183.1
[M+NH4]+ 381.13724 208.6
[M+K]+ 402.06658 181.6
[M-H]- 362.09614 175.0
[M+Na-2H]- 384.07809 178.1
[M]+ 363.10287 178.9
[M]- 363.10397 178.9
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.