CID 41585

(2-ethoxyphenyl)carbamic acid 2-(1-piperidinyl)ethyl ester hydrochloride

Structural Information

Molecular Formula
C16H24N2O3
SMILES
CCOC1=CC=CC=C1NC(=O)OCCN2CCCCC2
InChI
InChI=1S/C16H24N2O3/c1-2-20-15-9-5-4-8-14(15)17-16(19)21-13-12-18-10-6-3-7-11-18/h4-5,8-9H,2-3,6-7,10-13H2,1H3,(H,17,19)
InChIKey
AKAUVJAKQZMDKP-UHFFFAOYSA-N
Compound name
2-piperidin-1-ylethyl N-(2-ethoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

4
Patents

292.17868 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.18596 169.9
[M+Na]+ 315.16790 172.4
[M-H]- 291.17140 173.6
[M+NH4]+ 310.21250 183.0
[M+K]+ 331.14184 170.1
[M+H-H2O]+ 275.17594 160.5
[M+HCOO]- 337.17688 188.8
[M+CH3COO]- 351.19253 202.6
[M+Na-2H]- 313.15335 172.5
[M]+ 292.17813 168.3
[M]- 292.17923 168.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe