CID 165986818

Tert-butyl n-[2-(3-cyclopropylpiperazin-1-yl)ethyl]carbamate

Structural Information

Molecular Formula
C14H27N3O2
SMILES
CC(C)(C)OC(=O)NCCN1CCNC(C1)C2CC2
InChI
InChI=1S/C14H27N3O2/c1-14(2,3)19-13(18)16-7-9-17-8-6-15-12(10-17)11-4-5-11/h11-12,15H,4-10H2,1-3H3,(H,16,18)
InChIKey
NYYQYOUTSQICAN-UHFFFAOYSA-N
Compound name
tert-butyl N-[2-(3-cyclopropylpiperazin-1-yl)ethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.21033 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.217606 170.8
[M+Na]+ 292.199548 175.3
[M-H]- 268.203054 172.9
[M+NH4]+ 287.244153 179.0
[M+K]+ 308.173488 171.4
[M+H-H2O]+ 252.207590 162.8
[M+HCOO]- 314.208531 185.1
[M+CH3COO]- 328.224181 199.9
[M+Na-2H]- 290.184996 172.5
[M]+ 269.20978142 169.2
[M]- 269.21087858 169.2
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.