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]+ 327.243076 183.5
[M+Na]+ 349.225018 186.6
[M-H]- 325.228524 188.1
[M+NH4]+ 344.269623 198.6
[M+K]+ 365.198958 183.9
[M+H-H2O]+ 309.233060 175.7
[M+HCOO]- 371.234001 203.2
[M+CH3COO]- 385.249651 221.8
[M+Na-2H]- 347.210466 186.2
[M]+ 326.23525142 185.5
[M]- 326.23634858 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.