CID 92037252

1516571-16-6

Structural Information

Molecular Formula
C34H62N4O10
SMILES
C=COCCCCOC(=O)NCCCCCCNC(=O)OCCCCCCOC(=O)NCCCCCCNC(=O)OCCCCOC=C
InChI
InChI=1S/C34H62N4O10/c1-3-43-25-17-19-29-47-33(41)37-23-13-7-5-11-21-35-31(39)45-27-15-9-10-16-28-46-32(40)36-22-12-6-8-14-24-38-34(42)48-30-20-18-26-44-4-2/h3-4H,1-2,5-30H2,(H,35,39)(H,36,40)(H,37,41)(H,38,42)
InChIKey
HYUMTLCJAKNRKM-UHFFFAOYSA-N
Compound name
6-[6-(4-ethenoxybutoxycarbonylamino)hexylcarbamoyloxy]hexyl N-[6-(4-ethenoxybutoxycarbonylamino)hexyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

686.4466 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 687.45388 275.8
[M+Na]+ 709.43582 286.1
[M+NH4]+ 704.48042 282.7
[M+K]+ 725.40976 284.4
[M-H]- 685.43932 277.7
[M+Na-2H]- 707.42127 279.7
[M]+ 686.44605 279.0
[M]- 686.44715 279.0
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.