CID 132316044

2137882-84-7

Structural Information

Molecular Formula
C15H22N2O4
SMILES
CC(C)(C)OC(=O)NCC1=CC(=C2N1CCCC2)C(=O)O
InChI
InChI=1S/C15H22N2O4/c1-15(2,3)21-14(20)16-9-10-8-11(13(18)19)12-6-4-5-7-17(10)12/h8H,4-7,9H2,1-3H3,(H,16,20)(H,18,19)
InChIKey
UZHGBBFYYDHCEV-UHFFFAOYSA-N
Compound name
3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-5,6,7,8-tetrahydroindolizine-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.15796 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.16524 168.1
[M+Na]+ 317.14718 174.6
[M+NH4]+ 312.19178 173.1
[M+K]+ 333.12112 173.7
[M-H]- 293.15068 166.4
[M+Na-2H]- 315.13263 168.6
[M]+ 294.15741 168.0
[M]- 294.15851 168.0
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.