CID 199228

Brn 2720375

Structural Information

Molecular Formula
C14H27NO
SMILES
CC(C)(CCC(=O)C1CCCC1)CN(C)C
InChI
InChI=1S/C14H27NO/c1-14(2,11-15(3)4)10-9-13(16)12-7-5-6-8-12/h12H,5-11H2,1-4H3
InChIKey
OLDDOPCJXHXNJO-UHFFFAOYSA-N
Compound name
1-cyclopentyl-5-(dimethylamino)-4,4-dimethylpentan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.20926 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.21654 158.1
[M+Na]+ 248.19848 165.0
[M+NH4]+ 243.24308 165.6
[M+K]+ 264.17242 161.8
[M-H]- 224.20198 158.9
[M+Na-2H]- 246.18393 160.8
[M]+ 225.20871 159.0
[M]- 225.20981 159.0
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.