CID 3912574

20314-31-2

Structural Information

Molecular Formula
C19H26N4O2
SMILES
CC(C(=O)NC1=CC2=CC=CC=C2C=C1)NC(=O)C(CCCCN)N
InChI
InChI=1S/C19H26N4O2/c1-13(22-19(25)17(21)8-4-5-11-20)18(24)23-16-10-9-14-6-2-3-7-15(14)12-16/h2-3,6-7,9-10,12-13,17H,4-5,8,11,20-21H2,1H3,(H,22,25)(H,23,24)
InChIKey
MNETYPHAKOATDA-UHFFFAOYSA-N
Compound name
2,6-diamino-N-[1-(naphthalen-2-ylamino)-1-oxopropan-2-yl]hexanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

342.20557 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.21285 184.3
[M+Na]+ 365.19479 190.4
[M+NH4]+ 360.23939 189.4
[M+K]+ 381.16873 185.9
[M-H]- 341.19829 186.7
[M+Na-2H]- 363.18024 186.9
[M]+ 342.20502 185.2
[M]- 342.20612 185.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.