CID 137965816

2230798-95-3

Structural Information

Molecular Formula
C11H20N2O
SMILES
CN1CCC2(CC1)CN[C@H]3[C@@H]2COC3
InChI
InChI=1S/C11H20N2O/c1-13-4-2-11(3-5-13)8-12-10-7-14-6-9(10)11/h9-10,12H,2-8H2,1H3/t9-,10+/m0/s1
InChIKey
AECCGHMSPWHYEV-VHSXEESVSA-N
Compound name
(3aR,6aS)-1'-methylspiro[1,2,3a,4,6,6a-hexahydrofuro[3,4-b]pyrrole-3,4'-piperidine]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.15756 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.16484 147.2
[M+Na]+ 219.14678 152.4
[M-H]- 195.15028 149.2
[M+NH4]+ 214.19138 168.4
[M+K]+ 235.12072 150.4
[M+H-H2O]+ 179.15482 140.4
[M+HCOO]- 241.15576 160.3
[M+CH3COO]- 255.17141 158.0
[M+Na-2H]- 217.13223 148.9
[M]+ 196.15701 139.5
[M]- 196.15811 139.5
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

No patent data available for this compound.