CID 199374

Brn 2818017

Structural Information

Molecular Formula
C24H33NO
SMILES
CC(CN(C)C1CCCCCC1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C24H33NO/c1-20(19-25(2)23-17-11-3-4-12-18-23)24(26,21-13-7-5-8-14-21)22-15-9-6-10-16-22/h5-10,13-16,20,23,26H,3-4,11-12,17-19H2,1-2H3
InChIKey
OXTQHELIHQKFDF-UHFFFAOYSA-N
Compound name
3-[cycloheptyl(methyl)amino]-2-methyl-1,1-diphenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

351.25623 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.263506 186.5
[M+Na]+ 374.245448 184.8
[M-H]- 350.248954 194.6
[M+NH4]+ 369.290053 197.0
[M+K]+ 390.219388 185.7
[M+H-H2O]+ 334.253490 178.8
[M+HCOO]- 396.254431 201.7
[M+CH3COO]- 410.270081 217.4
[M+Na-2H]- 372.230896 187.2
[M]+ 351.25568142 178.3
[M]- 351.25677858 178.3
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.