CID 119329

Alaptide

Structural Information

Molecular Formula
C9H14N2O2
SMILES
C[C@H]1C(=O)NC2(CCCC2)C(=O)N1
InChI
InChI=1S/C9H14N2O2/c1-6-7(12)11-9(8(13)10-6)4-2-3-5-9/h6H,2-5H2,1H3,(H,10,13)(H,11,12)/t6-/m0/s1
InChIKey
LTRSPDHUDXWHRY-LURJTMIESA-N
Compound name
(8S)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

26
References

319
Patents

182.10553 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.11281 141.5
[M+Na]+ 205.09475 148.3
[M-H]- 181.09825 141.4
[M+NH4]+ 200.13935 161.4
[M+K]+ 221.06869 144.6
[M+H-H2O]+ 165.10279 135.4
[M+HCOO]- 227.10373 156.2
[M+CH3COO]- 241.11938 173.5
[M+Na-2H]- 203.08020 143.9
[M]+ 182.10498 133.1
[M]- 182.10608 133.1
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