CID 22924380

2913244-69-4

Structural Information

Molecular Formula
C11H22N2O3
SMILES
CC(C)(C)OC(=O)NCC1(CCNC1)OC
InChI
InChI=1S/C11H22N2O3/c1-10(2,3)16-9(14)13-8-11(15-4)5-6-12-7-11/h12H,5-8H2,1-4H3,(H,13,14)
InChIKey
SMJNSXWVOQHMLD-UHFFFAOYSA-N
Compound name
tert-butyl N-[(3-methoxypyrrolidin-3-yl)methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

230.16304 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.170316 155.2
[M+Na]+ 253.152258 159.6
[M-H]- 229.155764 155.4
[M+NH4]+ 248.196863 174.5
[M+K]+ 269.126198 159.0
[M+H-H2O]+ 213.160300 149.9
[M+HCOO]- 275.161241 173.4
[M+CH3COO]- 289.176891 187.0
[M+Na-2H]- 251.137706 159.1
[M]+ 230.16249142 154.1
[M]- 230.16358858 154.1
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