CID 12638300

76003-30-0

Structural Information

Molecular Formula
C10H18N2O3
SMILES
CC1C(=O)NCCN1C(=O)OC(C)(C)C
InChI
InChI=1S/C10H18N2O3/c1-7-8(13)11-5-6-12(7)9(14)15-10(2,3)4/h7H,5-6H2,1-4H3,(H,11,13)
InChIKey
KKVKQTLLEBWZTR-UHFFFAOYSA-N
Compound name
tert-butyl 2-methyl-3-oxopiperazine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

72
Patents

214.13174 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.13902 150.2
[M+Na]+ 237.12096 156.5
[M-H]- 213.12446 149.5
[M+NH4]+ 232.16556 165.9
[M+K]+ 253.09490 155.2
[M+H-H2O]+ 197.12900 144.0
[M+HCOO]- 259.12994 164.5
[M+CH3COO]- 273.14559 184.2
[M+Na-2H]- 235.10641 152.8
[M]+ 214.13119 147.8
[M]- 214.13229 147.8
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