CID 200732

Brn 1350657

Structural Information

Molecular Formula
C10H22N2O3P2S
SMILES
CCOP(=O)(CCP(=S)(N1CC1)N2CC2)OCC
InChI
InChI=1S/C10H22N2O3P2S/c1-3-14-17(13,15-4-2)10-9-16(18,11-5-6-11)12-7-8-12/h3-10H2,1-2H3
InChIKey
QQQZZRGHZMRLLR-UHFFFAOYSA-N
Compound name
bis(aziridin-1-yl)-(2-diethoxyphosphorylethyl)-sulfanylidene-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.08264 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.08992 183.7
[M+Na]+ 335.07186 188.9
[M-H]- 311.07536 185.5
[M+NH4]+ 330.11646 186.7
[M+K]+ 351.04580 186.1
[M+H-H2O]+ 295.07990 172.2
[M+HCOO]- 357.08084 204.1
[M+CH3COO]- 371.09649 213.0
[M+Na-2H]- 333.05731 179.9
[M]+ 312.08209 192.5
[M]- 312.08319 192.5
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.