CID 155859063

2580099-86-9

Structural Information

Molecular Formula
C11H19NO2
SMILES
COC(=O)C[C@@H]1CCNC[C@@H]1C2CC2
InChI
InChI=1S/C11H19NO2/c1-14-11(13)6-9-4-5-12-7-10(9)8-2-3-8/h8-10,12H,2-7H2,1H3/t9-,10+/m0/s1
InChIKey
YNHSIPZXDXRBCC-VHSXEESVSA-N
Compound name
methyl 2-[(3R,4S)-3-cyclopropylpiperidin-4-yl]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.14159 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.14887 148.0
[M+Na]+ 220.13081 154.1
[M-H]- 196.13431 151.9
[M+NH4]+ 215.17541 160.4
[M+K]+ 236.10475 151.1
[M+H-H2O]+ 180.13885 140.8
[M+HCOO]- 242.13979 165.0
[M+CH3COO]- 256.15544 184.8
[M+Na-2H]- 218.11626 150.2
[M]+ 197.14104 146.2
[M]- 197.14214 146.2
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.