CID 9860700

Sdz-210-086

Structural Information

Molecular Formula
C9H17NO2
SMILES
C[C@H]1OCC2(O1)CCN(CC2)C
InChI
InChI=1S/C9H17NO2/c1-8-11-7-9(12-8)3-5-10(2)6-4-9/h8H,3-7H2,1-2H3/t8-/m0/s1
InChIKey
VHBBMEXIWWKUNY-QMMMGPOBSA-N
Compound name
(2S)-2,8-dimethyl-1,3-dioxa-8-azaspiro[4.5]decane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

122
Patents

171.12593 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.133206 136.9
[M+Na]+ 194.115148 143.1
[M-H]- 170.118654 141.8
[M+NH4]+ 189.159753 157.3
[M+K]+ 210.089088 144.4
[M+H-H2O]+ 154.123190 131.2
[M+HCOO]- 216.124131 153.6
[M+CH3COO]- 230.139781 176.5
[M+Na-2H]- 192.100596 142.6
[M]+ 171.12538142 133.8
[M]- 171.12647858 133.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe