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

14
Patents

215.15215 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.15943 149.9
[M+Na]+ 238.14137 156.0
[M-H]- 214.14487 151.8
[M+NH4]+ 233.18597 169.5
[M+K]+ 254.11531 157.5
[M+H-H2O]+ 198.14941 145.5
[M+HCOO]- 260.15035 170.9
[M+CH3COO]- 274.16600 193.6
[M+Na-2H]- 236.12682 154.7
[M]+ 215.15160 154.7
[M]- 215.15270 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