CID 137935670

2253641-10-8

Structural Information

Molecular Formula
C11H20N2O3
SMILES
CC(C)(C)OC(=O)NC1CNC2C1COC2
InChI
InChI=1S/C11H20N2O3/c1-11(2,3)16-10(14)13-8-4-12-9-6-15-5-7(8)9/h7-9,12H,4-6H2,1-3H3,(H,13,14)
InChIKey
RGKSBCATNWZZSA-UHFFFAOYSA-N
Compound name
tert-butyl N-(2,3,3a,4,6,6a-hexahydro-1H-furo[3,4-b]pyrrol-3-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.1474 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.15468 154.5
[M+Na]+ 251.13662 159.1
[M-H]- 227.14012 156.3
[M+NH4]+ 246.18122 173.5
[M+K]+ 267.11056 158.9
[M+H-H2O]+ 211.14466 149.5
[M+HCOO]- 273.14560 170.8
[M+CH3COO]- 287.16125 186.9
[M+Na-2H]- 249.12207 157.0
[M]+ 228.14685 152.2
[M]- 228.14795 152.2
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.