CID 3042198

Dtxsid00974616

Structural Information

Molecular Formula
C27H31N
SMILES
C1CC(CCC1C2=CC=CC=C2)NCCC(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C27H31N/c1-4-10-22(11-5-1)23-16-18-26(19-17-23)28-21-20-27(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-15,23,26-28H,16-21H2
InChIKey
WBFMJHLIJFAXTP-UHFFFAOYSA-N
Compound name
N-(3,3-diphenylpropyl)-4-phenylcyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

369.24564 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.25292 192.4
[M+Na]+ 392.23486 192.3
[M-H]- 368.23836 202.1
[M+NH4]+ 387.27946 202.2
[M+K]+ 408.20880 185.1
[M+H-H2O]+ 352.24290 180.8
[M+HCOO]- 414.24384 210.2
[M+CH3COO]- 428.25949 199.5
[M+Na-2H]- 390.22031 193.7
[M]+ 369.24509 184.9
[M]- 369.24619 184.9
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.