CID 107072

68039-45-2

Structural Information

Molecular Formula

C₁₅H₂₂O₂

SMILES

CC(C)(C)C(=O)OC1CC2CC1C3C2CC=C3

InChI

InChI=1S/C15H22O2/c1-15(2,3)14(16)17-13-8-9-7-12(13)11-6-4-5-10(9)11/h4,6,9-13H,5,7-8H2,1-3H3

InChIKey

SARNDXMIYRKJOG-UHFFFAOYSA-N

Compound name

8-tricyclo[5.2.1.02,6]dec-4-enyl 2,2-dimethylpropanoate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 10
Patents: 234.16199 Da
Monoisotopic Mass: 3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	235.16927	155.1
[M+Na]+	257.15121	162.0
[M+NH4]+	252.19581	164.2
[M+K]+	273.12515	162.5
[M-H]-	233.15471	154.5
[M+Na-2H]-	255.13666	154.3
[M]+	234.16144	155.7
[M]-	234.16254	155.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe