CID 71757843

1104194-54-8

Structural Information

Molecular Formula
C10H19NO3
SMILES
CC(C)(C)OC(=O)N(C)C(C)(C)C=O
InChI
InChI=1S/C10H19NO3/c1-9(2,3)14-8(13)11(6)10(4,5)7-12/h7H,1-6H3
InChIKey
JUJWZUXFWXFHJZ-UHFFFAOYSA-N
Compound name
tert-butyl N-methyl-N-(2-methyl-1-oxopropan-2-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

73
Patents

201.13649 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.143766 145.0
[M+Na]+ 224.125708 151.4
[M-H]- 200.129214 147.0
[M+NH4]+ 219.170313 165.1
[M+K]+ 240.099648 153.1
[M+H-H2O]+ 184.133750 140.7
[M+HCOO]- 246.134691 166.2
[M+CH3COO]- 260.150341 191.2
[M+Na-2H]- 222.111156 150.3
[M]+ 201.13594142 149.5
[M]- 201.13703858 149.5
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