CID 203705

Brn 2765275

Structural Information

Molecular Formula
C21H30N2O
SMILES
CC(C)C(CCCN(C)C)(C1=CC=CC2=CC=CC=C21)C(=O)NC
InChI
InChI=1S/C21H30N2O/c1-16(2)21(20(24)22-3,14-9-15-23(4)5)19-13-8-11-17-10-6-7-12-18(17)19/h6-8,10-13,16H,9,14-15H2,1-5H3,(H,22,24)
InChIKey
MMPLVXBEVGJTNJ-UHFFFAOYSA-N
Compound name
5-(dimethylamino)-N-methyl-2-naphthalen-1-yl-2-propan-2-ylpentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

326.2358 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.24308 183.5
[M+Na]+ 349.22502 186.6
[M-H]- 325.22852 188.1
[M+NH4]+ 344.26962 198.6
[M+K]+ 365.19896 183.9
[M+H-H2O]+ 309.23306 175.7
[M+HCOO]- 371.23400 203.2
[M+CH3COO]- 385.24965 221.8
[M+Na-2H]- 347.21047 186.2
[M]+ 326.23525 185.5
[M]- 326.23635 185.5
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.