CID 541638

(4r,5r)-2-chloro-4,5-dimethyl-1,3,2-dioxaphospholane 2-oxide

Structural Information

Molecular Formula
C4H8ClO3P
SMILES
CC1C(OP(=O)(O1)Cl)C
InChI
InChI=1S/C4H8ClO3P/c1-3-4(2)8-9(5,6)7-3/h3-4H,1-2H3
InChIKey
NWEOITOLZSNNEX-UHFFFAOYSA-N
Compound name
2-chloro-4,5-dimethyl-1,3,2lambda5-dioxaphospholane 2-oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

169.98996 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.99724 128.0
[M+Na]+ 192.97918 138.5
[M-H]- 168.98268 132.4
[M+NH4]+ 188.02378 151.4
[M+K]+ 208.95312 139.0
[M+H-H2O]+ 152.98722 123.6
[M+HCOO]- 214.98816 151.4
[M+CH3COO]- 229.00381 175.1
[M+Na-2H]- 190.96463 132.7
[M]+ 169.98941 132.9
[M]- 169.99051 132.9
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

patents stripe