CID 210757

21602-46-0

Structural Information

Molecular Formula
C14H26N2
SMILES
CN1CCN(CC1)C2(CCCCC2)CC=C
InChI
InChI=1S/C14H26N2/c1-3-7-14(8-5-4-6-9-14)16-12-10-15(2)11-13-16/h3H,1,4-13H2,2H3
InChIKey
BRDRYQGYAFMUGG-UHFFFAOYSA-N
Compound name
1-methyl-4-(1-prop-2-enylcyclohexyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.2096 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.21688 157.7
[M+Na]+ 245.19882 160.2
[M-H]- 221.20232 159.5
[M+NH4]+ 240.24342 174.6
[M+K]+ 261.17276 157.2
[M+H-H2O]+ 205.20686 148.9
[M+HCOO]- 267.20780 170.9
[M+CH3COO]- 281.22345 189.4
[M+Na-2H]- 243.18427 159.7
[M]+ 222.20905 149.0
[M]- 222.21015 149.0
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.