CID 28059

K 912

Structural Information

Molecular Formula
C16H24Cl2N2O3
SMILES
CCCOC1=CC(=C(C(=C1)Cl)NC(=O)OCCN(CC)CC)Cl
InChI
InChI=1S/C16H24Cl2N2O3/c1-4-8-22-12-10-13(17)15(14(18)11-12)19-16(21)23-9-7-20(5-2)6-3/h10-11H,4-9H2,1-3H3,(H,19,21)
InChIKey
LHKBHVGCBCWWJS-UHFFFAOYSA-N
Compound name
2-(diethylamino)ethyl N-(2,6-dichloro-4-propoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.1164 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.12368 184.4
[M+Na]+ 385.10562 191.2
[M-H]- 361.10912 188.4
[M+NH4]+ 380.15022 199.1
[M+K]+ 401.07956 187.0
[M+H-H2O]+ 345.11366 178.5
[M+HCOO]- 407.11460 199.5
[M+CH3COO]- 421.13025 221.6
[M+Na-2H]- 383.09107 184.2
[M]+ 362.11585 193.8
[M]- 362.11695 193.8
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.