CID 121552811

2-methyl-2-{1,4,7-trioxaspiro[4.4]nonan-9-yl}propan-1-amine

Structural Information

Molecular Formula
C10H19NO3
SMILES
CC(C)(CN)C1COCC12OCCO2
InChI
InChI=1S/C10H19NO3/c1-9(2,6-11)8-5-12-7-10(8)13-3-4-14-10/h8H,3-7,11H2,1-2H3
InChIKey
UWHYSKFCPWYJPJ-UHFFFAOYSA-N
Compound name
2-methyl-2-(1,4,7-trioxaspiro[4.4]nonan-9-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.13649 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.14377 143.7
[M+Na]+ 224.12571 150.7
[M+NH4]+ 219.17031 152.7
[M+K]+ 240.09965 150.0
[M-H]- 200.12921 148.5
[M+Na-2H]- 222.11116 146.5
[M]+ 201.13594 146.0
[M]- 201.13704 146.0
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.