CID 80271

Tri-o-tolylphosphine

Structural Information

Molecular Formula
C21H21P
SMILES
CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C
InChI
InChI=1S/C21H21P/c1-16-10-4-7-13-19(16)22(20-14-8-5-11-17(20)2)21-15-9-6-12-18(21)3/h4-15H,1-3H3
InChIKey
COIOYMYWGDAQPM-UHFFFAOYSA-N
Compound name
tris(2-methylphenyl)phosphane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

12
References

55318
Patents

304.1381 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.145376 176.0
[M+Na]+ 327.127318 182.6
[M-H]- 303.130824 184.4
[M+NH4]+ 322.171923 191.2
[M+K]+ 343.101258 176.9
[M+H-H2O]+ 287.135360 164.6
[M+HCOO]- 349.136301 203.0
[M+CH3COO]- 363.151951 210.1
[M+Na-2H]- 325.112766 174.6
[M]+ 304.13755142 176.1
[M]- 304.13864858 176.1
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