CID 77884787

Methyl 2-propylprolinate

Structural Information

Molecular Formula
C9H17NO2
SMILES
CCCC1(CCCN1)C(=O)OC
InChI
InChI=1S/C9H17NO2/c1-3-5-9(8(11)12-2)6-4-7-10-9/h10H,3-7H2,1-2H3
InChIKey
GNAGNRYPVFRSKN-UHFFFAOYSA-N
Compound name
methyl 2-propylpyrrolidine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.12593 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.13321 140.9
[M+Na]+ 194.11515 149.1
[M+NH4]+ 189.15975 149.3
[M+K]+ 210.08909 144.2
[M-H]- 170.11865 140.0
[M+Na-2H]- 192.10060 144.9
[M]+ 171.12538 141.5
[M]- 171.12648 141.5
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.