CID 103865

54043-73-1

Structural Information

Molecular Formula
C15H24O2
SMILES
CC1=C(C(CC1)C(=C)C)CC(C)COC(=O)C
InChI
InChI=1S/C15H24O2/c1-10(2)14-7-6-12(4)15(14)8-11(3)9-17-13(5)16/h11,14H,1,6-9H2,2-5H3
InChIKey
RCULSNWXGDTJBO-UHFFFAOYSA-N
Compound name
[2-methyl-3-(2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl)propyl] acetate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

5
Patents

236.17763 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.18491 159.2
[M+Na]+ 259.16685 164.7
[M-H]- 235.17035 162.3
[M+NH4]+ 254.21145 179.0
[M+K]+ 275.14079 162.9
[M+H-H2O]+ 219.17489 153.8
[M+HCOO]- 281.17583 178.8
[M+CH3COO]- 295.19148 196.3
[M+Na-2H]- 257.15230 156.0
[M]+ 236.17708 160.8
[M]- 236.17818 160.8
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