CID 202075

7411-99-6

Structural Information

Molecular Formula
C27H33NO
SMILES
CC(C)(CCC(C1=CC=CC=C1)(C2=CC=CC=C2)O)C(C3=CC=CC=C3)N(C)C
InChI
InChI=1S/C27H33NO/c1-26(2,25(28(3)4)22-14-8-5-9-15-22)20-21-27(29,23-16-10-6-11-17-23)24-18-12-7-13-19-24/h5-19,25,29H,20-21H2,1-4H3
InChIKey
UUWVXJZTDPJZBG-UHFFFAOYSA-N
Compound name
5-(dimethylamino)-4,4-dimethyl-1,1,5-triphenylpentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

387.25623 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 388.26351 197.8
[M+Na]+ 410.24545 199.1
[M-H]- 386.24895 205.7
[M+NH4]+ 405.29005 207.7
[M+K]+ 426.21939 194.4
[M+H-H2O]+ 370.25349 188.0
[M+HCOO]- 432.25443 214.9
[M+CH3COO]- 446.27008 226.0
[M+Na-2H]- 408.23090 201.2
[M]+ 387.25568 197.0
[M]- 387.25678 197.0
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

No patent data available for this compound.