CID 6434090

Cinnamamide, n,n-bis(2-hydroxyethyl)-, bis(ethylcarbamate)

Structural Information

Molecular Formula
C19H27N3O5
SMILES
CCNC(=O)OCCN(CCOC(=O)NCC)C(=O)/C=C/C1=CC=CC=C1
InChI
InChI=1S/C19H27N3O5/c1-3-20-18(24)26-14-12-22(13-15-27-19(25)21-4-2)17(23)11-10-16-8-6-5-7-9-16/h5-11H,3-4,12-15H2,1-2H3,(H,20,24)(H,21,25)/b11-10+
InChIKey
JJHNNULOQHARSJ-ZHACJKMWSA-N
Compound name
2-[2-(ethylcarbamoyloxy)ethyl-[(E)-3-phenylprop-2-enoyl]amino]ethyl N-ethylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

377.19507 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.202346 192.8
[M+Na]+ 400.184288 193.7
[M-H]- 376.187794 196.1
[M+NH4]+ 395.228893 203.8
[M+K]+ 416.158228 193.1
[M+H-H2O]+ 360.192330 183.3
[M+HCOO]- 422.193271 216.5
[M+CH3COO]- 436.208921 225.5
[M+Na-2H]- 398.169736 192.6
[M]+ 377.19452142 197.1
[M]- 377.19561858 197.1
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.