CID 14263

3-methylcyclopentene

Structural Information

Molecular Formula
C6H10
SMILES
CC1CCC=C1
InChI
InChI=1S/C6H10/c1-6-4-2-3-5-6/h2,4,6H,3,5H2,1H3
InChIKey
CXOZQHPXKPDQGT-UHFFFAOYSA-N
Compound name
3-methylcyclopentene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3916
Patents

82.07825 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 83.085526 115.0
[M+Na]+ 105.06747 126.7
[M+NH4]+ 100.11207 125.4
[M+K]+ 121.04141 121.7
[M-H]- 81.070974 117.5
[M+Na-2H]- 103.05292 121.8
[M]+ 82.077701 117.3
[M]- 82.078799 117.3
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