CID 27327

K 904

Structural Information

Molecular Formula
C16H24Cl2N2O3
SMILES
CCCCCOC1=CC(=C(C(=C1)Cl)NC(=O)OCCN(C)C)Cl
InChI
InChI=1S/C16H24Cl2N2O3/c1-4-5-6-8-22-12-10-13(17)15(14(18)11-12)19-16(21)23-9-7-20(2)3/h10-11H,4-9H2,1-3H3,(H,19,21)
InChIKey
ZCOSJMARFAJEBF-UHFFFAOYSA-N
Compound name
2-(dimethylamino)ethyl N-(2,6-dichloro-4-pentoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.1164 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.12368 182.9
[M+Na]+ 385.10562 193.7
[M+NH4]+ 380.15022 189.3
[M+K]+ 401.07956 186.6
[M-H]- 361.10912 184.7
[M+Na-2H]- 383.09107 186.9
[M]+ 362.11585 185.3
[M]- 362.11695 185.3
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.