CID 43585084

1156827-98-3

Structural Information

Molecular Formula
C13H27N3
SMILES
CC(C)N1CCN(CC1)C2(CCCC2)CN
InChI
InChI=1S/C13H27N3/c1-12(2)15-7-9-16(10-8-15)13(11-14)5-3-4-6-13/h12H,3-11,14H2,1-2H3
InChIKey
GQZWUTMEQLBZBI-UHFFFAOYSA-N
Compound name
[1-(4-propan-2-ylpiperazin-1-yl)cyclopentyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.2205 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.22778 157.8
[M+Na]+ 248.20972 160.3
[M-H]- 224.21322 159.7
[M+NH4]+ 243.25432 176.0
[M+K]+ 264.18366 158.1
[M+H-H2O]+ 208.21776 149.5
[M+HCOO]- 270.21870 172.8
[M+CH3COO]- 284.23435 191.8
[M+Na-2H]- 246.19517 157.2
[M]+ 225.21995 149.4
[M]- 225.22105 149.4
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.