CID 53429465

886779-85-7

Structural Information

Molecular Formula
C12H22N2O2
SMILES
CC(C)(C)OC(=O)N1CCNC(C1)C2CC2
InChI
InChI=1S/C12H22N2O2/c1-12(2,3)16-11(15)14-7-6-13-10(8-14)9-4-5-9/h9-10,13H,4-8H2,1-3H3
InChIKey
HHEGEBMPXPIGCR-UHFFFAOYSA-N
Compound name
tert-butyl 3-cyclopropylpiperazine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

226.16812 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.17540 160.4
[M+Na]+ 249.15734 166.6
[M-H]- 225.16084 163.0
[M+NH4]+ 244.20194 170.6
[M+K]+ 265.13128 163.4
[M+H-H2O]+ 209.16538 152.9
[M+HCOO]- 271.16632 174.3
[M+CH3COO]- 285.18197 189.4
[M+Na-2H]- 247.14279 162.5
[M]+ 226.16757 158.8
[M]- 226.16867 158.8
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

No patent data available for this compound.