CID 105518110

1784620-11-6

Structural Information

Molecular Formula
C14H27N3O2
SMILES
CC(C)(C)OC(=O)NC1CCC(C1)N2CCNCC2
InChI
InChI=1S/C14H27N3O2/c1-14(2,3)19-13(18)16-11-4-5-12(10-11)17-8-6-15-7-9-17/h11-12,15H,4-10H2,1-3H3,(H,16,18)
InChIKey
LXBSANNSCSHVDB-UHFFFAOYSA-N
Compound name
tert-butyl N-(3-piperazin-1-ylcyclopentyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.21033 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.217606 168.1
[M+Na]+ 292.199548 169.6
[M-H]- 268.203054 169.1
[M+NH4]+ 287.244153 182.2
[M+K]+ 308.173488 167.4
[M+H-H2O]+ 252.207590 160.1
[M+HCOO]- 314.208531 181.0
[M+CH3COO]- 328.224181 195.2
[M+Na-2H]- 290.184996 167.8
[M]+ 269.20978142 160.5
[M]- 269.21087858 160.5
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.