CID 88243

1-ethyl-2-methylcyclopentene

Structural Information

Molecular Formula
C8H14
SMILES
CCC1=C(CCC1)C
InChI
InChI=1S/C8H14/c1-3-8-6-4-5-7(8)2/h3-6H2,1-2H3
InChIKey
MMYZGQDXYZNAQW-UHFFFAOYSA-N
Compound name
1-ethyl-2-methylcyclopentene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

59
Patents

110.10955 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.11683 123.3
[M+Na]+ 133.09877 135.0
[M+NH4]+ 128.14337 133.4
[M+K]+ 149.07271 129.8
[M-H]- 109.10227 125.8
[M+Na-2H]- 131.08422 129.4
[M]+ 110.10900 125.7
[M]- 110.11010 125.7
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