CID 25900

13349-34-3

Structural Information

Molecular Formula
C23H33NO2
SMILES
CC(C)C(CCCN(C)C)(C1=CC=CC2=CC=CC=C21)C(=O)OC(C)C
InChI
InChI=1S/C23H33NO2/c1-17(2)23(15-10-16-24(5)6,22(25)26-18(3)4)21-14-9-12-19-11-7-8-13-20(19)21/h7-9,11-14,17-18H,10,15-16H2,1-6H3
InChIKey
JSDBDARBENMOSW-UHFFFAOYSA-N
Compound name
propan-2-yl 5-(dimethylamino)-2-naphthalen-1-yl-2-propan-2-ylpentanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.25113 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.258406 191.8
[M+Na]+ 378.240348 194.4
[M-H]- 354.243854 196.1
[M+NH4]+ 373.284953 205.8
[M+K]+ 394.214288 192.5
[M+H-H2O]+ 338.248390 183.9
[M+HCOO]- 400.249331 208.9
[M+CH3COO]- 414.264981 225.6
[M+Na-2H]- 376.225796 191.8
[M]+ 355.25058142 196.0
[M]- 355.25167858 196.0
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.