CID 20067150

114214-73-2

Structural Information

Molecular Formula
C10H20N2O3
SMILES
CC(C)(C)OC(=O)N1CCC(C1)(CN)O
InChI
InChI=1S/C10H20N2O3/c1-9(2,3)15-8(13)12-5-4-10(14,6-11)7-12/h14H,4-7,11H2,1-3H3
InChIKey
MCGDVVXFTUKWNU-UHFFFAOYSA-N
Compound name
tert-butyl 3-(aminomethyl)-3-hydroxypyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

45
Patents

216.1474 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.154676 150.4
[M+Na]+ 239.136618 156.3
[M-H]- 215.140124 150.7
[M+NH4]+ 234.181223 170.5
[M+K]+ 255.110558 155.6
[M+H-H2O]+ 199.144660 145.8
[M+HCOO]- 261.145601 168.4
[M+CH3COO]- 275.161251 184.6
[M+Na-2H]- 237.122066 153.3
[M]+ 216.14685142 148.4
[M]- 216.14794858 148.4
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

patents stripe