CID 91752244

7,9-illudadiene-3,14-diol

Structural Information

Molecular Formula
C15H22O2
SMILES
CC1(CC2C(=C1)C=C(C3(C2(C)O)CC3)CO)C
InChI
InChI=1S/C15H22O2/c1-13(2)7-10-6-11(9-16)15(4-5-15)14(3,17)12(10)8-13/h6-7,12,16-17H,4-5,8-9H2,1-3H3
InChIKey
YEDYYAKSTVQMBN-UHFFFAOYSA-N
Compound name
6-(hydroxymethyl)-2,2,4-trimethylspiro[3,3a-dihydroindene-5,1'-cyclopropane]-4-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

234.16199 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.16927 153.3
[M+Na]+ 257.15121 164.4
[M-H]- 233.15471 158.8
[M+NH4]+ 252.19581 174.5
[M+K]+ 273.12515 160.8
[M+H-H2O]+ 217.15925 151.0
[M+HCOO]- 279.16019 169.7
[M+CH3COO]- 293.17584 191.0
[M+Na-2H]- 255.13666 158.6
[M]+ 234.16144 156.0
[M]- 234.16254 156.0
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.