CID 18541

Ammonium, (2-(2-(1-naphthylmethyl)-3-(tetrahydro-2-furyl)propoxy)ethyl)trimethyl-, iodide

Structural Information

Molecular Formula
C23H34NO2
SMILES
C[N+](C)(C)CCOCC(CC1CCCO1)CC2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C23H34NO2/c1-24(2,3)13-15-25-18-19(17-22-11-7-14-26-22)16-21-10-6-9-20-8-4-5-12-23(20)21/h4-6,8-10,12,19,22H,7,11,13-18H2,1-3H3/q+1
InChIKey
YHCVZNGZHXNNOK-UHFFFAOYSA-N
Compound name
trimethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propoxy]ethyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.25894 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.26622 191.9
[M+Na]+ 379.24816 193.9
[M-H]- 355.25166 199.7
[M+NH4]+ 374.29276 205.9
[M+K]+ 395.22210 185.9
[M+H-H2O]+ 339.25620 186.3
[M+HCOO]- 401.25714 209.6
[M+CH3COO]- 415.27279 214.2
[M+Na-2H]- 377.23361 196.4
[M]+ 356.25839 192.7
[M]- 356.25949 192.7
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.