CID 14159864

Tert-butyl n-[(2r)-3-cyano-2-hydroxypropyl]carbamate

Structural Information

Molecular Formula
C9H16N2O3
SMILES
CC(C)(C)OC(=O)NC[C@@H](CC#N)O
InChI
InChI=1S/C9H16N2O3/c1-9(2,3)14-8(13)11-6-7(12)4-5-10/h7,12H,4,6H2,1-3H3,(H,11,13)/t7-/m1/s1
InChIKey
IYEDXPKCFGTWDN-SSDOTTSWSA-N
Compound name
tert-butyl N-[(2R)-3-cyano-2-hydroxypropyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

200.11609 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.12337 146.1
[M+Na]+ 223.10531 152.5
[M+NH4]+ 218.14991 148.0
[M+K]+ 239.07925 147.0
[M-H]- 199.10881 136.4
[M+Na-2H]- 221.09076 145.0
[M]+ 200.11554 143.0
[M]- 200.11664 143.0
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.