CID 146050144

2413846-30-5

Structural Information

Molecular Formula
C9H15NO3
SMILES
COC(=O)[C@]12CNC[C@H]1CCCO2
InChI
InChI=1S/C9H15NO3/c1-12-8(11)9-6-10-5-7(9)3-2-4-13-9/h7,10H,2-6H2,1H3/t7-,9+/m1/s1
InChIKey
UVJCHRVVVLCIQO-APPZFPTMSA-N
Compound name
methyl (4aR,7aR)-3,4,4a,5,6,7-hexahydro-2H-pyrano[2,3-c]pyrrole-7a-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.1052 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.11248 141.7
[M+Na]+ 208.09442 149.9
[M+NH4]+ 203.13902 150.7
[M+K]+ 224.06836 145.8
[M-H]- 184.09792 142.5
[M+Na-2H]- 206.07987 144.5
[M]+ 185.10465 142.8
[M]- 185.10575 142.8
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.