CID 5242583

2-diphenylphosphino-6-methylpyridine

Structural Information

Molecular Formula
C18H16NP
SMILES
CC1=NC(=CC=C1)P(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C18H16NP/c1-15-9-8-14-18(19-15)20(16-10-4-2-5-11-16)17-12-6-3-7-13-17/h2-14H,1H3
InChIKey
XEXYRTTUCDBSPJ-UHFFFAOYSA-N
Compound name
(6-methylpyridin-2-yl)-diphenylphosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

151
Patents

277.10205 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.10933 166.9
[M+Na]+ 300.09127 172.8
[M-H]- 276.09477 173.5
[M+NH4]+ 295.13587 181.1
[M+K]+ 316.06521 167.5
[M+H-H2O]+ 260.09931 154.7
[M+HCOO]- 322.10025 193.5
[M+CH3COO]- 336.11590 177.9
[M+Na-2H]- 298.07672 168.6
[M]+ 277.10150 165.5
[M]- 277.10260 165.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe