CID 61899

Dodemorph

Structural Information

Molecular Formula
C18H35NO
SMILES
CC1CN(CC(O1)C)C2CCCCCCCCCCC2
InChI
InChI=1S/C18H35NO/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18/h16-18H,3-15H2,1-2H3
InChIKey
JMXKCYUTURMERF-UHFFFAOYSA-N
Compound name
4-cyclododecyl-2,6-dimethylmorpholine
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

6
References

32393
Patents

281.27185 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.27913 171.4
[M+Na]+ 304.26107 170.9
[M-H]- 280.26457 172.4
[M+NH4]+ 299.30567 181.2
[M+K]+ 320.23501 170.1
[M+H-H2O]+ 264.26911 165.9
[M+HCOO]- 326.27005 180.9
[M+CH3COO]- 340.28570 195.5
[M+Na-2H]- 302.24652 168.9
[M]+ 281.27130 158.1
[M]- 281.27240 158.1
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.