CID 21955213

Tert-butyl n-tert-butyl-n-(2-oxoethyl)carbamate

Structural Information

Molecular Formula
C11H21NO3
SMILES
CC(C)(C)N(CC=O)C(=O)OC(C)(C)C
InChI
InChI=1S/C11H21NO3/c1-10(2,3)12(7-8-13)9(14)15-11(4,5)6/h8H,7H2,1-6H3
InChIKey
KUADEIPKYZMRBG-UHFFFAOYSA-N
Compound name
tert-butyl N-tert-butyl-N-(2-oxoethyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

215.15215 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.159426 149.9
[M+Na]+ 238.141368 156.0
[M-H]- 214.144874 151.8
[M+NH4]+ 233.185973 169.5
[M+K]+ 254.115308 157.5
[M+H-H2O]+ 198.149410 145.5
[M+HCOO]- 260.150351 170.9
[M+CH3COO]- 274.166001 193.6
[M+Na-2H]- 236.126816 154.7
[M]+ 215.15160142 154.7
[M]- 215.15269858 154.7
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