CID 208223

10-(alpha-methyl-beta-phenyl)ethylamino-10,11-dihydro-5h-dibenzo(a,d)cycloheptene hcl

Structural Information

Molecular Formula
C24H25N
SMILES
CC(CC1=CC=CC=C1)NC2CC3=CC=CC=C3CC4=CC=CC=C24
InChI
InChI=1S/C24H25N/c1-18(15-19-9-3-2-4-10-19)25-24-17-21-12-6-5-11-20(21)16-22-13-7-8-14-23(22)24/h2-14,18,24-25H,15-17H2,1H3
InChIKey
INQHOQDWEDCEHY-UHFFFAOYSA-N
Compound name
N-(1-phenylpropan-2-yl)tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-9-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

327.1987 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.20598 180.4
[M+Na]+ 350.18792 184.3
[M-H]- 326.19142 188.7
[M+NH4]+ 345.23252 194.8
[M+K]+ 366.16186 181.9
[M+H-H2O]+ 310.19596 173.9
[M+HCOO]- 372.19690 198.9
[M+CH3COO]- 386.21255 189.7
[M+Na-2H]- 348.17337 185.4
[M]+ 327.19815 175.4
[M]- 327.19925 175.4
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.