CID 114868499

Dtxsid101366068

Structural Information

Molecular Formula
C18H35NO
SMILES
CC(C)CC1C(NCC2(O1)CCC(CC2)(C)C)C(C)C
InChI
InChI=1S/C18H35NO/c1-13(2)11-15-16(14(3)4)19-12-18(20-15)9-7-17(5,6)8-10-18/h13-16,19H,7-12H2,1-6H3
InChIKey
UDNTXEFTESSQSL-UHFFFAOYSA-N
Compound name
9,9-dimethyl-2-(2-methylpropyl)-3-propan-2-yl-1-oxa-4-azaspiro[5.5]undecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.27185 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.279126 173.0
[M+Na]+ 304.261068 175.4
[M-H]- 280.264574 174.8
[M+NH4]+ 299.305673 189.9
[M+K]+ 320.235008 173.9
[M+H-H2O]+ 264.269110 166.6
[M+HCOO]- 326.270051 181.7
[M+CH3COO]- 340.285701 201.9
[M+Na-2H]- 302.246516 172.3
[M]+ 281.27130142 166.5
[M]- 281.27239858 166.5
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.