CID 200178

Brn 1327328

Structural Information

Molecular Formula
C20H33NO5
SMILES
COC1=CC=CC=C1OCCOCCOCCOCCN2CCCCC2
InChI
InChI=1S/C20H33NO5/c1-22-19-7-3-4-8-20(19)26-18-17-25-16-15-24-14-13-23-12-11-21-9-5-2-6-10-21/h3-4,7-8H,2,5-6,9-18H2,1H3
InChIKey
ITLWYZUYTIXEEP-UHFFFAOYSA-N
Compound name
1-[2-[2-[2-[2-(2-methoxyphenoxy)ethoxy]ethoxy]ethoxy]ethyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

367.23587 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 368.24315 189.8
[M+Na]+ 390.22509 190.8
[M-H]- 366.22859 192.4
[M+NH4]+ 385.26969 199.8
[M+K]+ 406.19903 189.0
[M+H-H2O]+ 350.23313 179.1
[M+HCOO]- 412.23407 207.3
[M+CH3COO]- 426.24972 214.7
[M+Na-2H]- 388.21054 191.1
[M]+ 367.23532 194.5
[M]- 367.23642 194.5
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.