CID 3009952

Spiro[[?]-3,3'-pyrrolidine]

Structural Information

Molecular Formula
C13H21N
SMILES
C1CC2C(C1)C3CC2CC34CCNC4
InChI
InChI=1S/C13H21N/c1-2-10-9-6-12(11(10)3-1)13(7-9)4-5-14-8-13/h9-12,14H,1-8H2
InChIKey
MPVNVFNJRVPMSC-UHFFFAOYSA-N
Compound name
spiro[pyrrolidine-3,8'-tricyclo[5.2.1.02,6]decane]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

191.1674 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.17468 152.7
[M+Na]+ 214.15662 158.6
[M-H]- 190.16012 155.9
[M+NH4]+ 209.20122 181.4
[M+K]+ 230.13056 154.5
[M+H-H2O]+ 174.16466 148.1
[M+HCOO]- 236.16560 168.5
[M+CH3COO]- 250.18125 164.1
[M+Na-2H]- 212.14207 150.6
[M]+ 191.16685 145.9
[M]- 191.16795 145.9
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.