CID 78899

N,n-dimethyl-n'-naphthylpropane-1,3-diamine

Structural Information

Molecular Formula
C15H20N2
SMILES
CN(C)CCCNC1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C15H20N2/c1-17(2)12-6-11-16-15-10-5-8-13-7-3-4-9-14(13)15/h3-5,7-10,16H,6,11-12H2,1-2H3
InChIKey
UXKSOKMNCZEVNT-UHFFFAOYSA-N
Compound name
N',N'-dimethyl-N-naphthalen-1-ylpropane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

228.16264 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.169916 152.9
[M+Na]+ 251.151858 158.5
[M-H]- 227.155364 158.2
[M+NH4]+ 246.196463 172.1
[M+K]+ 267.125798 155.6
[M+H-H2O]+ 211.159900 145.4
[M+HCOO]- 273.160841 177.9
[M+CH3COO]- 287.176491 201.2
[M+Na-2H]- 249.137306 160.4
[M]+ 228.16209142 153.8
[M]- 228.16318858 153.8
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

patents stripe