CID 46142

Kl 3516

Structural Information

Molecular Formula
C17H26N2O4
SMILES
CCCOC1=CC(=C(C=C1)NC(=O)OCCN2CCOCC2)C
InChI
InChI=1S/C17H26N2O4/c1-3-9-22-15-4-5-16(14(2)13-15)18-17(20)23-12-8-19-6-10-21-11-7-19/h4-5,13H,3,6-12H2,1-2H3,(H,18,20)
InChIKey
DQNDDDBRAOOTJR-UHFFFAOYSA-N
Compound name
2-morpholin-4-ylethyl N-(2-methyl-4-propoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.18927 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.196546 178.6
[M+Na]+ 345.178488 181.6
[M-H]- 321.181994 183.1
[M+NH4]+ 340.223093 189.4
[M+K]+ 361.152428 180.6
[M+H-H2O]+ 305.186530 168.9
[M+HCOO]- 367.187471 196.4
[M+CH3COO]- 381.203121 209.1
[M+Na-2H]- 343.163936 180.7
[M]+ 322.18872142 179.8
[M]- 322.18981858 179.8
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.