CID 101519

Myomontanone

Structural Information

Molecular Formula
C15H20O2
SMILES
C[C@H]1CC(=C(C1)C(=O)C2=COC=C2)CC(C)C
InChI
InChI=1S/C15H20O2/c1-10(2)6-13-7-11(3)8-14(13)15(16)12-4-5-17-9-12/h4-5,9-11H,6-8H2,1-3H3/t11-/m0/s1
InChIKey
ROMXQUBLTVIACV-NSHDSACASA-N
Compound name
furan-3-yl-[(4S)-4-methyl-2-(2-methylpropyl)cyclopenten-1-yl]methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

232.14633 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.15361 155.2
[M+Na]+ 255.13555 165.5
[M+NH4]+ 250.18015 163.3
[M+K]+ 271.10949 163.7
[M-H]- 231.13905 159.0
[M+Na-2H]- 253.12100 159.4
[M]+ 232.14578 157.6
[M]- 232.14688 157.6
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

No patent data available for this compound.