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]+ 241.191056 164.8
[M+Na]+ 263.172998 171.3
[M-H]- 239.176504 167.5
[M+NH4]+ 258.217603 176.4
[M+K]+ 279.146938 168.9
[M+H-H2O]+ 223.181040 158.3
[M+HCOO]- 285.181981 178.0
[M+CH3COO]- 299.197631 191.8
[M+Na-2H]- 261.158446 167.5
[M]+ 240.18323142 163.9
[M]- 240.18432858 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.