CID 215619

35957-57-4

Structural Information

Molecular Formula
C22H38N2O2
SMILES
CC(CC1(CN(C(=O)N(C1)C2CCCCC2)C3CCCCC3)CC=C)O
InChI
InChI=1S/C22H38N2O2/c1-3-14-22(15-18(2)25)16-23(19-10-6-4-7-11-19)21(26)24(17-22)20-12-8-5-9-13-20/h3,18-20,25H,1,4-17H2,2H3
InChIKey
PMDIHOLLEQNGKZ-UHFFFAOYSA-N
Compound name
1,3-dicyclohexyl-5-(2-hydroxypropyl)-5-prop-2-enyl-1,3-diazinan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.29333 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.30061 196.5
[M+Na]+ 385.28255 204.3
[M+NH4]+ 380.32715 204.0
[M+K]+ 401.25649 195.5
[M-H]- 361.28605 199.6
[M+Na-2H]- 383.26800 200.0
[M]+ 362.29278 198.2
[M]- 362.29388 198.2
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.