CID 41625

55792-29-5

Structural Information

Molecular Formula
C24H40N2O3
SMILES
CCCCCCCCCCOC1=CC=CC=C1NC(=O)OCCN2CCCCC2
InChI
InChI=1S/C24H40N2O3/c1-2-3-4-5-6-7-8-14-20-28-23-16-11-10-15-22(23)25-24(27)29-21-19-26-17-12-9-13-18-26/h10-11,15-16H,2-9,12-14,17-21H2,1H3,(H,25,27)
InChIKey
JFHMGYQPQJYPCZ-UHFFFAOYSA-N
Compound name
2-piperidin-1-ylethyl N-(2-decoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

40
Patents

404.3039 Da
Monoisotopic Mass

6.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 405.31118 204.8
[M+Na]+ 427.29312 203.7
[M-H]- 403.29662 206.8
[M+NH4]+ 422.33772 213.2
[M+K]+ 443.26706 199.6
[M+H-H2O]+ 387.30116 193.8
[M+HCOO]- 449.30210 220.9
[M+CH3COO]- 463.31775 226.3
[M+Na-2H]- 425.27857 203.3
[M]+ 404.30335 206.0
[M]- 404.30445 206.0
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