CID 59032

N'-(5,6,7,8-tetrahydro-1-naphthyl)-n,n,n-trimethylformamidinium iodide

Structural Information

Molecular Formula
C14H21N2
SMILES
C[N+](C)(C)C=NC1=CC=CC2=C1CCCC2
InChI
InChI=1S/C14H21N2/c1-16(2,3)11-15-14-10-6-8-12-7-4-5-9-13(12)14/h6,8,10-11H,4-5,7,9H2,1-3H3/q+1
InChIKey
DTXRVGFSTOLKIZ-UHFFFAOYSA-N
Compound name
trimethyl(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.17047 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.17775 147.4
[M+Na]+ 240.15969 152.7
[M-H]- 216.16319 154.1
[M+NH4]+ 235.20429 167.8
[M+K]+ 256.13363 145.1
[M+H-H2O]+ 200.16773 143.5
[M+HCOO]- 262.16867 170.5
[M+CH3COO]- 276.18432 192.7
[M+Na-2H]- 238.14514 158.2
[M]+ 217.16992 144.8
[M]- 217.17102 144.8
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

No patent data available for this compound.