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]+ 307.165236 171.1
[M+Na]+ 329.147178 176.0
[M-H]- 305.150684 175.5
[M+NH4]+ 324.191783 184.7
[M+K]+ 345.121118 173.7
[M+H-H2O]+ 289.155220 162.1
[M+HCOO]- 351.156161 185.6
[M+CH3COO]- 365.171811 198.1
[M+Na-2H]- 327.132626 173.3
[M]+ 306.15741142 168.5
[M]- 306.15850858 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.