CID 67232756

Tert-butyl n-(2-hydroxyethyl)-n-(pyrrolidin-3-yl)carbamate

Structural Information

Molecular Formula
C11H22N2O3
SMILES
CC(C)(C)OC(=O)N(CCO)C1CCNC1
InChI
InChI=1S/C11H22N2O3/c1-11(2,3)16-10(15)13(6-7-14)9-4-5-12-8-9/h9,12,14H,4-8H2,1-3H3
InChIKey
ZATYBKXWOIQBML-UHFFFAOYSA-N
Compound name
tert-butyl N-(2-hydroxyethyl)-N-pyrrolidin-3-ylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

230.16304 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.170316 156.6
[M+Na]+ 253.152258 159.8
[M-H]- 229.155764 156.5
[M+NH4]+ 248.196863 173.8
[M+K]+ 269.126198 159.5
[M+H-H2O]+ 213.160300 150.2
[M+HCOO]- 275.161241 173.8
[M+CH3COO]- 289.176891 188.3
[M+Na-2H]- 251.137706 157.8
[M]+ 230.16249142 154.4
[M]- 230.16358858 154.4
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