CID 549586

2-methyl-2-(4-methylpent-3-enyl)cyclopropanecarbaldehyde

Structural Information

Molecular Formula
C11H18O
SMILES
CC(=CCCC1(CC1C=O)C)C
InChI
InChI=1S/C11H18O/c1-9(2)5-4-6-11(3)7-10(11)8-12/h5,8,10H,4,6-7H2,1-3H3
InChIKey
HVRSGXFUZOKZNT-UHFFFAOYSA-N
Compound name
2-methyl-2-(4-methylpent-3-enyl)cyclopropane-1-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

166.13577 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.14305 139.4
[M+Na]+ 189.12499 151.5
[M+NH4]+ 184.16959 149.3
[M+K]+ 205.09893 145.0
[M-H]- 165.12849 147.2
[M+Na-2H]- 187.11044 147.5
[M]+ 166.13522 144.5
[M]- 166.13632 144.5
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

patents stripe