CID 212033

23804-93-5

Structural Information

Molecular Formula
C16H22N2O4
SMILES
COC1=CC=CC=C1OCCN2CCC3(CC2)CNC(=O)O3
InChI
InChI=1S/C16H22N2O4/c1-20-13-4-2-3-5-14(13)21-11-10-18-8-6-16(7-9-18)12-17-15(19)22-16/h2-5H,6-12H2,1H3,(H,17,19)
InChIKey
BTWRFTXXQLAQBS-UHFFFAOYSA-N
Compound name
8-[2-(2-methoxyphenoxy)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.15796 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.16524 171.1
[M+Na]+ 329.14718 176.0
[M-H]- 305.15068 175.5
[M+NH4]+ 324.19178 184.7
[M+K]+ 345.12112 173.7
[M+H-H2O]+ 289.15522 162.1
[M+HCOO]- 351.15616 185.6
[M+CH3COO]- 365.17181 198.1
[M+Na-2H]- 327.13263 173.3
[M]+ 306.15741 168.5
[M]- 306.15851 168.5
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.