CID 115926913

Dtxsid801366071

Structural Information

Molecular Formula
C18H37NO
SMILES
CCCCC(CC)CC(CNCCOC)C1CCCC1
InChI
InChI=1S/C18H37NO/c1-4-6-9-16(5-2)14-18(15-19-12-13-20-3)17-10-7-8-11-17/h16-19H,4-15H2,1-3H3
InChIKey
JHEWZWINMZSPCN-UHFFFAOYSA-N
Compound name
2-cyclopentyl-4-ethyl-N-(2-methoxyethyl)octan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.2875 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.294776 180.4
[M+Na]+ 306.276718 180.3
[M-H]- 282.280224 181.3
[M+NH4]+ 301.321323 197.3
[M+K]+ 322.250658 178.1
[M+H-H2O]+ 266.284760 172.8
[M+HCOO]- 328.285701 198.8
[M+CH3COO]- 342.301351 207.8
[M+Na-2H]- 304.262166 177.1
[M]+ 283.28695142 180.6
[M]- 283.28804858 180.6
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.