CID 146050126

2-(dimethylphosphoryl)-2-phenylpyrrolidine

Structural Information

Molecular Formula
C12H18NOP
SMILES
CP(=O)(C)C1(CCCN1)C2=CC=CC=C2
InChI
InChI=1S/C12H18NOP/c1-15(2,14)12(9-6-10-13-12)11-7-4-3-5-8-11/h3-5,7-8,13H,6,9-10H2,1-2H3
InChIKey
VFFUXLNCYASPDZ-UHFFFAOYSA-N
Compound name
2-dimethylphosphoryl-2-phenylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.1126 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.11988 153.5
[M+Na]+ 246.10182 159.3
[M-H]- 222.10532 155.9
[M+NH4]+ 241.14642 173.6
[M+K]+ 262.07576 156.1
[M+H-H2O]+ 206.10986 144.9
[M+HCOO]- 268.11080 177.5
[M+CH3COO]- 282.12645 184.7
[M+Na-2H]- 244.08727 155.5
[M]+ 223.11205 150.1
[M]- 223.11315 150.1
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.