CID 3048786

Kl 3616

Structural Information

Molecular Formula
C18H28N2O4
SMILES
CCCCOC1=CC(=C(C=C1)NC(=O)OCCN2CCOCC2)C
InChI
InChI=1S/C18H28N2O4/c1-3-4-10-23-16-5-6-17(15(2)14-16)19-18(21)24-13-9-20-7-11-22-12-8-20/h5-6,14H,3-4,7-13H2,1-2H3,(H,19,21)
InChIKey
PZOZAMFUSVHWHZ-UHFFFAOYSA-N
Compound name
2-morpholin-4-ylethyl N-(4-butoxy-2-methylphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

336.2049 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.212176 183.0
[M+Na]+ 359.194118 185.6
[M-H]- 335.197624 187.4
[M+NH4]+ 354.238723 193.3
[M+K]+ 375.168058 184.4
[M+H-H2O]+ 319.202160 173.2
[M+HCOO]- 381.203101 200.5
[M+CH3COO]- 395.218751 212.0
[M+Na-2H]- 357.179566 184.7
[M]+ 336.20435142 184.6
[M]- 336.20544858 184.6
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.