CID 76172

Tri-p-tolylarsine

Structural Information

Molecular Formula
C21H21As
SMILES
CC1=CC=C(C=C1)[As](C2=CC=C(C=C2)C)C3=CC=C(C=C3)C
InChI
InChI=1S/C21H21As/c1-16-4-10-19(11-5-16)22(20-12-6-17(2)7-13-20)21-14-8-18(3)9-15-21/h4-15H,1-3H3
InChIKey
YFJORWSFSOXFQR-UHFFFAOYSA-N
Compound name
tris(4-methylphenyl)arsane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

115
Patents

348.0859 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.09318 180.7
[M+Na]+ 371.07512 187.2
[M-H]- 347.07862 189.8
[M+NH4]+ 366.11972 195.5
[M+K]+ 387.04906 181.0
[M+H-H2O]+ 331.08316 171.1
[M+HCOO]- 393.08410 201.9
[M+CH3COO]- 407.09975 191.5
[M+Na-2H]- 369.06057 182.3
[M]+ 348.08535 180.2
[M]- 348.08645 180.2
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