CID 14500

Cyclopentanone oxime

Structural Information

Molecular Formula
C5H9NO
SMILES
C1CCC(=NO)C1
InChI
InChI=1S/C5H9NO/c7-6-5-3-1-2-4-5/h7H,1-4H2
InChIKey
YGNXYFLJZILPEK-UHFFFAOYSA-N
Compound name
N-cyclopentylidenehydroxylamine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1
References

1333
Patents

99.06841 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.07569 118.0
[M+Na]+ 122.05763 124.4
[M-H]- 98.061134 121.4
[M+NH4]+ 117.10223 142.5
[M+K]+ 138.03157 124.0
[M+H-H2O]+ 82.065670 112.9
[M+HCOO]- 144.06661 143.1
[M+CH3COO]- 158.08226 165.3
[M+Na-2H]- 120.04308 124.4
[M]+ 99.067861 114.1
[M]- 99.068959 114.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe