CID 2736510

1-heptylpiperazine

Structural Information

Molecular Formula
C11H24N2
SMILES
CCCCCCCN1CCNCC1
InChI
InChI=1S/C11H24N2/c1-2-3-4-5-6-9-13-10-7-12-8-11-13/h12H,2-11H2,1H3
InChIKey
GFFSNSPNXPELQE-UHFFFAOYSA-N
Compound name
1-heptylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

116
Patents

184.19395 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.20123 148.5
[M+Na]+ 207.18317 151.5
[M-H]- 183.18667 146.0
[M+NH4]+ 202.22777 164.7
[M+K]+ 223.15711 148.8
[M+H-H2O]+ 167.19121 140.7
[M+HCOO]- 229.19215 163.8
[M+CH3COO]- 243.20780 181.3
[M+Na-2H]- 205.16862 152.0
[M]+ 184.19340 143.9
[M]- 184.19450 143.9
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

patents stripe