CID 3722461

131173-04-1

Structural Information

Molecular Formula
C18H24NOP
SMILES
CC(C)N(C(C)C)P(=O)(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C18H24NOP/c1-15(2)19(16(3)4)21(20,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-16H,1-4H3
InChIKey
DOUWMTROIMIUBU-UHFFFAOYSA-N
Compound name
N-diphenylphosphoryl-N-propan-2-ylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

301.15955 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.16683 175.4
[M+Na]+ 324.14877 178.9
[M-H]- 300.15227 181.4
[M+NH4]+ 319.19337 190.7
[M+K]+ 340.12271 176.8
[M+H-H2O]+ 284.15681 164.9
[M+HCOO]- 346.15775 201.7
[M+CH3COO]- 360.17340 212.5
[M+Na-2H]- 322.13422 175.0
[M]+ 301.15900 176.6
[M]- 301.16010 176.6
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