CID 3077272

134069-86-6

Structural Information

Molecular Formula
C19H26N2O4
SMILES
CN1C(=C)C2(CCN(CC2)CCC3=CC(=C(C=C3)OC)OC)OC1=O
InChI
InChI=1S/C19H26N2O4/c1-14-19(25-18(22)20(14)2)8-11-21(12-9-19)10-7-15-5-6-16(23-3)17(13-15)24-4/h5-6,13H,1,7-12H2,2-4H3
InChIKey
WMSREPCOSWPFEC-UHFFFAOYSA-N
Compound name
8-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-4-methylidene-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

346.18927 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.19655 183.8
[M+Na]+ 369.17849 195.1
[M+NH4]+ 364.22309 191.1
[M+K]+ 385.15243 189.1
[M-H]- 345.18199 187.5
[M+Na-2H]- 367.16394 188.2
[M]+ 346.18872 186.4
[M]- 346.18982 186.4
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.