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

23
Patents

202.13174 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.13902 147.8
[M+Na]+ 225.12096 152.5
[M-H]- 201.12446 147.5
[M+NH4]+ 220.16556 166.1
[M+K]+ 241.09490 153.3
[M+H-H2O]+ 185.12900 142.5
[M+HCOO]- 247.12994 168.6
[M+CH3COO]- 261.14559 190.5
[M+Na-2H]- 223.10641 149.7
[M]+ 202.13119 147.7
[M]- 202.13229 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