CID 50986101

Solavetivol

Structural Information

Molecular Formula
C15H24O
SMILES
C[C@@H]1CC(C=C([C@]12CC[C@H](C2)C(=C)C)C)O
InChI
InChI=1S/C15H24O/c1-10(2)13-5-6-15(9-13)11(3)7-14(16)8-12(15)4/h7,12-14,16H,1,5-6,8-9H2,2-4H3/t12-,13-,14?,15-/m1/s1
InChIKey
QRPWLSKPROEDAH-QKGHYUKFSA-N
Compound name
(3R,5S,6R)-6,10-dimethyl-3-prop-1-en-2-ylspiro[4.5]dec-9-en-8-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

21
Patents

220.18271 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.18999 153.6
[M+Na]+ 243.17193 159.7
[M-H]- 219.17543 157.7
[M+NH4]+ 238.21653 176.0
[M+K]+ 259.14587 155.9
[M+H-H2O]+ 203.17997 149.1
[M+HCOO]- 265.18091 170.5
[M+CH3COO]- 279.19656 189.1
[M+Na-2H]- 241.15738 152.8
[M]+ 220.18216 148.5
[M]- 220.18326 148.5
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.