CID 33229

N,n-dimethyl-1-naphthalenepropylamine hydrochloride

Structural Information

Molecular Formula
C15H19N
SMILES
CN(C)CCCC1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C15H19N/c1-16(2)12-6-10-14-9-5-8-13-7-3-4-11-15(13)14/h3-5,7-9,11H,6,10,12H2,1-2H3
InChIKey
RKRSLNMXXPUVPE-UHFFFAOYSA-N
Compound name
N,N-dimethyl-3-naphthalen-1-ylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

213.15175 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.15903 149.3
[M+Na]+ 236.14097 155.8
[M-H]- 212.14447 154.8
[M+NH4]+ 231.18557 169.6
[M+K]+ 252.11491 153.0
[M+H-H2O]+ 196.14901 142.3
[M+HCOO]- 258.14995 173.3
[M+CH3COO]- 272.16560 196.3
[M+Na-2H]- 234.12642 156.5
[M]+ 213.15120 151.0
[M]- 213.15230 151.0
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

patents stripe