CID 55298899

945460-43-5

Structural Information

Molecular Formula
C5H12NOP
SMILES
CP1(=O)CCNCC1
InChI
InChI=1S/C5H12NOP/c1-8(7)4-2-6-3-5-8/h6H,2-5H2,1H3
InChIKey
UHFYKYIWDOJNDR-UHFFFAOYSA-N
Compound name
4-methyl-1,4lambda5-azaphosphinane 4-oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

104
Patents

133.06566 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.07294 128.6
[M+Na]+ 156.05488 134.8
[M-H]- 132.05838 127.9
[M+NH4]+ 151.09948 150.8
[M+K]+ 172.02882 133.7
[M+H-H2O]+ 116.06292 121.4
[M+HCOO]- 178.06386 152.8
[M+CH3COO]- 192.07951 167.9
[M+Na-2H]- 154.04033 132.4
[M]+ 133.06511 123.9
[M]- 133.06621 123.9
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