CID 3009946

Spiro[adamantane-2,3'-pyrrolidine]

Structural Information

Molecular Formula
C13H21N
SMILES
C1CNCC12C3CC4CC(C3)CC2C4
InChI
InChI=1S/C13H21N/c1-2-14-8-13(1)11-4-9-3-10(6-11)7-12(13)5-9/h9-12,14H,1-8H2
InChIKey
DWSGKVKRCLBYAA-UHFFFAOYSA-N
Compound name
spiro[adamantane-2,3'-pyrrolidine]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

191.1674 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.17468 142.5
[M+Na]+ 214.15662 144.0
[M-H]- 190.16012 137.8
[M+NH4]+ 209.20122 168.5
[M+K]+ 230.13056 139.1
[M+H-H2O]+ 174.16466 135.1
[M+HCOO]- 236.16560 146.8
[M+CH3COO]- 250.18125 150.7
[M+Na-2H]- 212.14207 149.9
[M]+ 191.16685 137.1
[M]- 191.16795 137.1
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.