CID 206518

50341-73-6

Structural Information

Molecular Formula
C21H32N2
SMILES
CCN(CC)CCN(CC1=CC=CC2=CC=CC=C21)CC(C)C
InChI
InChI=1S/C21H32N2/c1-5-22(6-2)14-15-23(16-18(3)4)17-20-12-9-11-19-10-7-8-13-21(19)20/h7-13,18H,5-6,14-17H2,1-4H3
InChIKey
GYCYZBKSGOTMEO-UHFFFAOYSA-N
Compound name
N,N-diethyl-N'-(2-methylpropyl)-N'-(naphthalen-1-ylmethyl)ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.25656 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.26384 182.4
[M+Na]+ 335.24578 185.1
[M-H]- 311.24928 188.0
[M+NH4]+ 330.29038 198.6
[M+K]+ 351.21972 182.7
[M+H-H2O]+ 295.25382 173.5
[M+HCOO]- 357.25476 204.7
[M+CH3COO]- 371.27041 223.4
[M+Na-2H]- 333.23123 184.4
[M]+ 312.25601 186.0
[M]- 312.25711 186.0
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.