CID 6451183

Spiro(naphthalene-2(1h),2'-oxirane)-1-propanol, alpha-ethenyloctahydro-alpha,5,5,8a-tetramethyl-

Structural Information

Molecular Formula
C20H34O2
SMILES
CC1(CCCC2(C1CCC3(C2CCC(C)(C=C)O)CO3)C)C
InChI
InChI=1S/C20H34O2/c1-6-18(4,21)12-8-16-19(5)11-7-10-17(2,3)15(19)9-13-20(16)14-22-20/h6,15-16,21H,1,7-14H2,2-5H3
InChIKey
KSDHFBZOHPERNV-UHFFFAOYSA-N
Compound name
5-(5,5,8a-trimethylspiro[3,4,4a,6,7,8-hexahydro-1H-naphthalene-2,2'-oxirane]-1-yl)-3-methylpent-1-en-3-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

306.2559 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.263176 176.5
[M+Na]+ 329.245118 182.8
[M-H]- 305.248624 181.8
[M+NH4]+ 324.289723 192.1
[M+K]+ 345.219058 181.9
[M+H-H2O]+ 289.253160 172.4
[M+HCOO]- 351.254101 185.5
[M+CH3COO]- 365.269751 207.3
[M+Na-2H]- 327.230566 181.5
[M]+ 306.25535142 176.9
[M]- 306.25644858 176.9
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

No patent data available for this compound.