CID 130004366

1824447-22-4

Structural Information

Molecular Formula
C12H20N2O3
SMILES
CC(C(C1=CC=CO1)NC(=O)OC(C)(C)C)N
InChI
InChI=1S/C12H20N2O3/c1-8(13)10(9-6-5-7-16-9)14-11(15)17-12(2,3)4/h5-8,10H,13H2,1-4H3,(H,14,15)
InChIKey
YNIOSHIJMIWUIR-UHFFFAOYSA-N
Compound name
tert-butyl N-[2-amino-1-(furan-2-yl)propyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.1474 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.154676 158.9
[M+Na]+ 263.136618 163.1
[M-H]- 239.140124 162.5
[M+NH4]+ 258.181223 175.9
[M+K]+ 279.110558 164.0
[M+H-H2O]+ 223.144660 152.7
[M+HCOO]- 285.145601 179.9
[M+CH3COO]- 299.161251 195.9
[M+Na-2H]- 261.122066 161.0
[M]+ 240.14685142 159.5
[M]- 240.14794858 159.5
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.