CID 46937140

Tert-butyl n-[(1r)-2-methyl-1-(1,3,4-oxadiazol-2-yl)propyl]carbamate

Structural Information

Molecular Formula
C11H19N3O3
SMILES
CC(C)[C@H](C1=NN=CO1)NC(=O)OC(C)(C)C
InChI
InChI=1S/C11H19N3O3/c1-7(2)8(9-14-12-6-16-9)13-10(15)17-11(3,4)5/h6-8H,1-5H3,(H,13,15)/t8-/m1/s1
InChIKey
PARUDDGQWSBIIO-MRVPVSSYSA-N
Compound name
tert-butyl N-[(1R)-2-methyl-1-(1,3,4-oxadiazol-2-yl)propyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.14264 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.14992 157.5
[M+Na]+ 264.13186 163.1
[M-H]- 240.13536 159.1
[M+NH4]+ 259.17646 172.5
[M+K]+ 280.10580 164.5
[M+H-H2O]+ 224.13990 150.2
[M+HCOO]- 286.14084 176.0
[M+CH3COO]- 300.15649 193.8
[M+Na-2H]- 262.11731 160.8
[M]+ 241.14209 160.6
[M]- 241.14319 160.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.