CID 258370

5-phenyl-5h-benzo[b]phosphindole

Structural Information

Molecular Formula
C18H13P
SMILES
C1=CC=C(C=C1)P2C3=CC=CC=C3C4=CC=CC=C42
InChI
InChI=1S/C18H13P/c1-2-8-14(9-3-1)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)19/h1-13H
InChIKey
DNPJAMMRVRYLOB-UHFFFAOYSA-N
Compound name
5-phenylbenzo[b]phosphindole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

82
Patents

260.0755 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.08278 159.6
[M+Na]+ 283.06472 169.2
[M-H]- 259.06822 167.4
[M+NH4]+ 278.10932 180.4
[M+K]+ 299.03866 162.8
[M+H-H2O]+ 243.07276 149.7
[M+HCOO]- 305.07370 189.0
[M+CH3COO]- 319.08935 172.9
[M+Na-2H]- 281.05017 163.1
[M]+ 260.07495 161.0
[M]- 260.07605 161.0
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