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]+ 323.19655 178.6
[M+Na]+ 345.17849 181.6
[M-H]- 321.18199 183.1
[M+NH4]+ 340.22309 189.4
[M+K]+ 361.15243 180.6
[M+H-H2O]+ 305.18653 168.9
[M+HCOO]- 367.18747 196.4
[M+CH3COO]- 381.20312 209.1
[M+Na-2H]- 343.16394 180.7
[M]+ 322.18872 179.8
[M]- 322.18982 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.