CID 31883

23379-35-3

Structural Information

Molecular Formula
C23H32N2O3
SMILES
CCCCOC1=CC=CC(=C1)N(C2=CC=CC=C2)C(=O)OCCN(CC)CC
InChI
InChI=1S/C23H32N2O3/c1-4-7-17-27-22-15-11-14-21(19-22)25(20-12-9-8-10-13-20)23(26)28-18-16-24(5-2)6-3/h8-15,19H,4-7,16-18H2,1-3H3
InChIKey
QZXOZUCLQGQYOJ-UHFFFAOYSA-N
Compound name
2-(diethylamino)ethyl N-(3-butoxyphenyl)-N-phenylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

384.2413 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.248576 198.8
[M+Na]+ 407.230518 200.6
[M-H]- 383.234024 206.5
[M+NH4]+ 402.275123 210.5
[M+K]+ 423.204458 199.2
[M+H-H2O]+ 367.238560 188.1
[M+HCOO]- 429.239501 222.8
[M+CH3COO]- 443.255151 231.3
[M+Na-2H]- 405.215966 199.2
[M]+ 384.24075142 205.1
[M]- 384.24184858 205.1
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.