CID 33237

N,n-diethyl-1-naphthalenepropylamine hydrochloride

Structural Information

Molecular Formula
C17H23N
SMILES
CCN(CC)CCCC1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C17H23N/c1-3-18(4-2)14-8-12-16-11-7-10-15-9-5-6-13-17(15)16/h5-7,9-11,13H,3-4,8,12,14H2,1-2H3
InChIKey
FHZSUVOZVZTREK-UHFFFAOYSA-N
Compound name
N,N-diethyl-3-naphthalen-1-ylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

241.18304 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.19032 158.8
[M+Na]+ 264.17226 164.4
[M-H]- 240.17576 163.9
[M+NH4]+ 259.21686 177.9
[M+K]+ 280.14620 161.0
[M+H-H2O]+ 224.18030 151.3
[M+HCOO]- 286.18124 182.1
[M+CH3COO]- 300.19689 202.3
[M+Na-2H]- 262.15771 164.8
[M]+ 241.18249 161.2
[M]- 241.18359 161.2
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.