CID 29948442

Tert-butyl n-{2-[(2s)-pyrrolidin-2-yl]ethyl}carbamate hydrochloride

Structural Information

Molecular Formula
C11H22N2O2
SMILES
CC(C)(C)OC(=O)NCC[C@@H]1CCCN1
InChI
InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13-8-6-9-5-4-7-12-9/h9,12H,4-8H2,1-3H3,(H,13,14)/t9-/m0/s1
InChIKey
UNANQGCDACTJPA-VIFPVBQESA-N
Compound name
tert-butyl N-[2-[(2S)-pyrrolidin-2-yl]ethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

214.16812 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.17540 153.9
[M+Na]+ 237.15734 157.5
[M-H]- 213.16084 153.8
[M+NH4]+ 232.20194 172.0
[M+K]+ 253.13128 156.2
[M+H-H2O]+ 197.16538 147.6
[M+HCOO]- 259.16632 171.9
[M+CH3COO]- 273.18197 185.4
[M+Na-2H]- 235.14279 156.2
[M]+ 214.16757 151.0
[M]- 214.16867 151.0
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.