CID 65196627

Dtxsid301365892

Structural Information

Molecular Formula
C18H37NO
SMILES
CCCCCCCCCCC1(CCC1)CNCCOC
InChI
InChI=1S/C18H37NO/c1-3-4-5-6-7-8-9-10-12-18(13-11-14-18)17-19-15-16-20-2/h19H,3-17H2,1-2H3
InChIKey
JBOQISHYKLHVGD-UHFFFAOYSA-N
Compound name
N-[(1-decylcyclobutyl)methyl]-2-methoxyethanamine
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 177.4
[M+Na]+ 306.276718 177.8
[M-H]- 282.280224 178.8
[M+NH4]+ 301.321323 188.4
[M+K]+ 322.250658 178.0
[M+H-H2O]+ 266.284760 165.9
[M+HCOO]- 328.285701 196.6
[M+CH3COO]- 342.301351 210.2
[M+Na-2H]- 304.262166 178.9
[M]+ 283.28695142 189.5
[M]- 283.28804858 189.5
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.