CID 3044070

Brn 1000636

Structural Information

Molecular Formula
C15H23NO3
SMILES
CCC1(C(=O)N(C(=C)OC1=O)C2CCCCC2)CC
InChI
InChI=1S/C15H23NO3/c1-4-15(5-2)13(17)16(11(3)19-14(15)18)12-9-7-6-8-10-12/h12H,3-10H2,1-2H3
InChIKey
DRZFDUIONSEVKJ-UHFFFAOYSA-N
Compound name
3-cyclohexyl-5,5-diethyl-2-methylidene-1,3-oxazinane-4,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.1678 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.17508 161.7
[M+Na]+ 288.15702 167.3
[M-H]- 264.16052 166.7
[M+NH4]+ 283.20162 177.7
[M+K]+ 304.13096 165.5
[M+H-H2O]+ 248.16506 154.7
[M+HCOO]- 310.16600 176.0
[M+CH3COO]- 324.18165 198.0
[M+Na-2H]- 286.14247 162.8
[M]+ 265.16725 157.9
[M]- 265.16835 157.9
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.