CID 427635

Nsc 215135

Structural Information

Molecular Formula
C14H26N
SMILES
CCCCCC[N+]12CCCC1C(=C)CC2
InChI
InChI=1S/C14H26N/c1-3-4-5-6-10-15-11-7-8-14(15)13(2)9-12-15/h14H,2-12H2,1H3/q+1
InChIKey
GYTLQKVSZMZTAW-UHFFFAOYSA-N
Compound name
4-hexyl-7-methylidene-1,2,3,5,6,8-hexahydropyrrolizin-4-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.20653 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.21381 153.9
[M+Na]+ 231.19575 159.4
[M-H]- 207.19925 156.1
[M+NH4]+ 226.24035 177.9
[M+K]+ 247.16969 150.4
[M+H-H2O]+ 191.20379 150.8
[M+HCOO]- 253.20473 172.2
[M+CH3COO]- 267.22038 181.5
[M+Na-2H]- 229.18120 157.1
[M]+ 208.20598 150.1
[M]- 208.20708 150.1
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.