CID 11206706

290815-01-9

Structural Information

Molecular Formula
C11H24N2O2
SMILES
CC(C)(C)[C@@H](CN)NC(=O)OC(C)(C)C
InChI
InChI=1S/C11H24N2O2/c1-10(2,3)8(7-12)13-9(14)15-11(4,5)6/h8H,7,12H2,1-6H3,(H,13,14)/t8-/m1/s1
InChIKey
PZCDWEOQKBSMMC-MRVPVSSYSA-N
Compound name
tert-butyl N-[(2S)-1-amino-3,3-dimethylbutan-2-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

56
Patents

216.18378 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.19106 154.5
[M+Na]+ 239.17300 158.9
[M-H]- 215.17650 154.2
[M+NH4]+ 234.21760 172.7
[M+K]+ 255.14694 159.3
[M+H-H2O]+ 199.18104 149.7
[M+HCOO]- 261.18198 173.7
[M+CH3COO]- 275.19763 194.2
[M+Na-2H]- 237.15845 157.5
[M]+ 216.18323 154.5
[M]- 216.18433 154.5
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

patents stripe