CID 4166619

75774-79-7

Structural Information

Molecular Formula
C22H23N
SMILES
CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)(C3=CC=C(C=C3)C)N
InChI
InChI=1S/C22H23N/c1-16-4-10-19(11-5-16)22(23,20-12-6-17(2)7-13-20)21-14-8-18(3)9-15-21/h4-15H,23H2,1-3H3
InChIKey
XWCAKECWGZSJKC-UHFFFAOYSA-N
Compound name
tris(4-methylphenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

301.18304 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.19032 174.6
[M+Na]+ 324.17226 181.5
[M-H]- 300.17576 183.9
[M+NH4]+ 319.21686 189.0
[M+K]+ 340.14620 175.2
[M+H-H2O]+ 284.18030 165.8
[M+HCOO]- 346.18124 196.3
[M+CH3COO]- 360.19689 210.0
[M+Na-2H]- 322.15771 178.7
[M]+ 301.18249 172.7
[M]- 301.18359 172.7
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