CID 23446090

143979-23-1

Structural Information

Molecular Formula
C9H18N2O3
SMILES
CC(CNC(=O)OC(C)(C)C)C(=O)N
InChI
InChI=1S/C9H18N2O3/c1-6(7(10)12)5-11-8(13)14-9(2,3)4/h6H,5H2,1-4H3,(H2,10,12)(H,11,13)
InChIKey
PFAQHEWBPXANNT-UHFFFAOYSA-N
Compound name
tert-butyl N-(3-amino-2-methyl-3-oxopropyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

202.13174 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.139016 147.8
[M+Na]+ 225.120958 152.5
[M-H]- 201.124464 147.5
[M+NH4]+ 220.165563 166.1
[M+K]+ 241.094898 153.3
[M+H-H2O]+ 185.129000 142.5
[M+HCOO]- 247.129941 168.6
[M+CH3COO]- 261.145591 190.5
[M+Na-2H]- 223.106406 149.7
[M]+ 202.13119142 147.7
[M]- 202.13228858 147.7
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