CID 3060633

78219-26-8

Structural Information

Molecular Formula
C16H22N2O4
SMILES
CCOC(=O)C1CN(CCC1OC(=O)C2=CC=C(C=C2)N)C
InChI
InChI=1S/C16H22N2O4/c1-3-21-16(20)13-10-18(2)9-8-14(13)22-15(19)11-4-6-12(17)7-5-11/h4-7,13-14H,3,8-10,17H2,1-2H3
InChIKey
AMWTXHSISWGTSU-UHFFFAOYSA-N
Compound name
ethyl 4-(4-aminobenzoyl)oxy-1-methylpiperidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.15796 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.16524 172.1
[M+Na]+ 329.14718 181.6
[M+NH4]+ 324.19178 177.6
[M+K]+ 345.12112 177.1
[M-H]- 305.15068 173.9
[M+Na-2H]- 327.13263 175.9
[M]+ 306.15741 173.5
[M]- 306.15851 173.5
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.