CID 44828534

1-[(tert-butoxy)carbonyl]-3-isocyanopyrrolidine

Structural Information

Molecular Formula
C10H16N2O2
SMILES
CC(C)(C)OC(=O)N1CCC(C1)[N+]#[C-]
InChI
InChI=1S/C10H16N2O2/c1-10(2,3)14-9(13)12-6-5-8(7-12)11-4/h8H,5-7H2,1-3H3
InChIKey
CCOTXXVUCIOSMC-UHFFFAOYSA-N
Compound name
tert-butyl 3-isocyanopyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

196.12119 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.12847 143.3
[M+Na]+ 219.11041 152.9
[M+NH4]+ 214.15501 147.2
[M+K]+ 235.08435 148.9
[M-H]- 195.11391 136.4
[M+Na-2H]- 217.09586 143.7
[M]+ 196.12064 141.6
[M]- 196.12174 141.6
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