CID 3073508

149749-93-9

Structural Information

Molecular Formula
C24H38N2O3
SMILES
CCN(CC)CC1C2CCC(C1OC(=O)NC3=CC=CC=C3OCC)(C2(C)C)C
InChI
InChI=1S/C24H38N2O3/c1-7-26(8-2)16-17-18-14-15-24(6,23(18,4)5)21(17)29-22(27)25-19-12-10-11-13-20(19)28-9-3/h10-13,17-18,21H,7-9,14-16H2,1-6H3,(H,25,27)
InChIKey
PWBUVUDPNVXFCO-UHFFFAOYSA-N
Compound name
[3-(diethylaminomethyl)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] N-(2-ethoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

402.28824 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 403.29552 199.6
[M+Na]+ 425.27746 205.8
[M+NH4]+ 420.32206 209.0
[M+K]+ 441.25140 199.6
[M-H]- 401.28096 201.9
[M+Na-2H]- 423.26291 203.0
[M]+ 402.28769 201.1
[M]- 402.28879 201.1
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.