CID 132773

146667-75-6

Structural Information

Molecular Formula
C26H29NO
SMILES
CN(CCC1=CC=C(C=C1)C2=CC=CC=C2)CC3CCCC4=C3C=CC(=C4)O
InChI
InChI=1S/C26H29NO/c1-27(19-24-9-5-8-23-18-25(28)14-15-26(23)24)17-16-20-10-12-22(13-11-20)21-6-3-2-4-7-21/h2-4,6-7,10-15,18,24,28H,5,8-9,16-17,19H2,1H3
InChIKey
UTBRFUHMQQIVFL-UHFFFAOYSA-N
Compound name
5-[[methyl-[2-(4-phenylphenyl)ethyl]amino]methyl]-5,6,7,8-tetrahydronaphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

371.2249 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.23218 192.6
[M+Na]+ 394.21412 195.9
[M-H]- 370.21762 201.5
[M+NH4]+ 389.25872 204.5
[M+K]+ 410.18806 189.5
[M+H-H2O]+ 354.22216 181.9
[M+HCOO]- 416.22310 211.0
[M+CH3COO]- 430.23875 201.0
[M+Na-2H]- 392.19957 194.7
[M]+ 371.22435 189.9
[M]- 371.22545 189.9
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

No patent data available for this compound.