CID 346980

N-propylnaphthalen-1-amine

Structural Information

Molecular Formula
C13H15N
SMILES
CCCNC1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C13H15N/c1-2-10-14-13-9-5-7-11-6-3-4-8-12(11)13/h3-9,14H,2,10H2,1H3
InChIKey
WHOYKONBZHXCFI-UHFFFAOYSA-N
Compound name
N-propylnaphthalen-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

290
Patents

185.12045 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.12773 139.4
[M+Na]+ 208.10967 146.7
[M-H]- 184.11317 143.8
[M+NH4]+ 203.15427 160.2
[M+K]+ 224.08361 142.9
[M+H-H2O]+ 168.11771 133.0
[M+HCOO]- 230.11865 163.7
[M+CH3COO]- 244.13430 186.8
[M+Na-2H]- 206.09512 148.5
[M]+ 185.11990 139.2
[M]- 185.12100 139.2
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

patents stripe