CID 57304

97769-25-0

Structural Information

Molecular Formula
C16H24N2O4
SMILES
COC1=CC=CC=C1NC(=O)OCC(CN2CCCCC2)O
InChI
InChI=1S/C16H24N2O4/c1-21-15-8-4-3-7-14(15)17-16(20)22-12-13(19)11-18-9-5-2-6-10-18/h3-4,7-8,13,19H,2,5-6,9-12H2,1H3,(H,17,20)
InChIKey
AQRGWYMHXSXNIR-UHFFFAOYSA-N
Compound name
(2-hydroxy-3-piperidin-1-ylpropyl) N-(2-methoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

308.1736 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.18088 172.8
[M+Na]+ 331.16282 174.4
[M-H]- 307.16632 175.1
[M+NH4]+ 326.20742 184.3
[M+K]+ 347.13676 172.5
[M+H-H2O]+ 291.17086 163.7
[M+HCOO]- 353.17180 189.4
[M+CH3COO]- 367.18745 203.2
[M+Na-2H]- 329.14827 173.9
[M]+ 308.17305 170.2
[M]- 308.17415 170.2
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.