CID 59333147

Ethyl 7-azaspiro[3.5]nonane-2-carboxylate hydrochloride

Structural Information

Molecular Formula
C11H19NO2
SMILES
CCOC(=O)C1CC2(C1)CCNCC2
InChI
InChI=1S/C11H19NO2/c1-2-14-10(13)9-7-11(8-9)3-5-12-6-4-11/h9,12H,2-8H2,1H3
InChIKey
UKNIQBMKECWWFM-UHFFFAOYSA-N
Compound name
ethyl 7-azaspiro[3.5]nonane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

197.14159 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.14887 145.1
[M+Na]+ 220.13081 148.2
[M-H]- 196.13431 146.9
[M+NH4]+ 215.17541 157.9
[M+K]+ 236.10475 149.4
[M+H-H2O]+ 180.13885 134.2
[M+HCOO]- 242.13979 159.8
[M+CH3COO]- 256.15544 183.3
[M+Na-2H]- 218.11626 148.8
[M]+ 197.14104 148.5
[M]- 197.14214 148.5
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

patents stripe