CID 3042200

Mg 8927

Structural Information

Molecular Formula
C30H37N
SMILES
CC(CC1=CC=C(C=C1)C2CCCCC2)NCCC(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C30H37N/c1-24(23-25-17-19-27(20-18-25)26-11-5-2-6-12-26)31-22-21-30(28-13-7-3-8-14-28)29-15-9-4-10-16-29/h3-4,7-10,13-20,24,26,30-31H,2,5-6,11-12,21-23H2,1H3
InChIKey
HPCLTRWXSRADOQ-UHFFFAOYSA-N
Compound name
N-[1-(4-cyclohexylphenyl)propan-2-yl]-3,3-diphenylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

411.2926 Da
Monoisotopic Mass

8.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 412.29988 205.6
[M+Na]+ 434.28182 203.8
[M-H]- 410.28532 214.6
[M+NH4]+ 429.32642 213.5
[M+K]+ 450.25576 196.5
[M+H-H2O]+ 394.28986 193.5
[M+HCOO]- 456.29080 221.3
[M+CH3COO]- 470.30645 211.2
[M+Na-2H]- 432.26727 204.0
[M]+ 411.29205 198.4
[M]- 411.29315 198.4
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.