CID 137951587

Tert-butyl 3-cyclopropyl-3-methylpiperazine-1-carboxylate

Structural Information

Molecular Formula
C13H24N2O2
SMILES
CC1(CN(CCN1)C(=O)OC(C)(C)C)C2CC2
InChI
InChI=1S/C13H24N2O2/c1-12(2,3)17-11(16)15-8-7-14-13(4,9-15)10-5-6-10/h10,14H,5-9H2,1-4H3
InChIKey
YUTLMPCHAWLGFL-UHFFFAOYSA-N
Compound name
tert-butyl 3-cyclopropyl-3-methylpiperazine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.18378 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.19106 164.8
[M+Na]+ 263.17300 171.3
[M-H]- 239.17650 167.5
[M+NH4]+ 258.21760 176.4
[M+K]+ 279.14694 168.9
[M+H-H2O]+ 223.18104 158.3
[M+HCOO]- 285.18198 178.0
[M+CH3COO]- 299.19763 191.8
[M+Na-2H]- 261.15845 167.5
[M]+ 240.18323 163.9
[M]- 240.18433 163.9
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.