CID 44890871

886366-35-4

Structural Information

Molecular Formula
C10H17NO4
SMILES
CC(CN1CCC(C1)C(=O)O)C(=O)OC
InChI
InChI=1S/C10H17NO4/c1-7(10(14)15-2)5-11-4-3-8(6-11)9(12)13/h7-8H,3-6H2,1-2H3,(H,12,13)
InChIKey
GJTHPVJBARVULH-UHFFFAOYSA-N
Compound name
1-(3-methoxy-2-methyl-3-oxopropyl)pyrrolidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.11575 Da
Monoisotopic Mass

-2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.12303 149.3
[M+Na]+ 238.10497 154.2
[M-H]- 214.10847 149.6
[M+NH4]+ 233.14957 167.3
[M+K]+ 254.07891 154.1
[M+H-H2O]+ 198.11301 143.2
[M+HCOO]- 260.11395 166.7
[M+CH3COO]- 274.12960 184.7
[M+Na-2H]- 236.09042 147.9
[M]+ 215.11520 148.7
[M]- 215.11630 148.7
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.