CID 20268659

1-oxaspiro[4.5]deca-3,6-diene, 2,7-dimethyl-10-(1-methylethyl)-

Structural Information

Molecular Formula
C14H22O
SMILES
CC1C=CC2(O1)C=C(CCC2C(C)C)C
InChI
InChI=1S/C14H22O/c1-10(2)13-6-5-11(3)9-14(13)8-7-12(4)15-14/h7-10,12-13H,5-6H2,1-4H3
InChIKey
QQLMXACDDRGTPU-UHFFFAOYSA-N
Compound name
2,9-dimethyl-6-propan-2-yl-1-oxaspiro[4.5]deca-3,9-diene
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

350
Patents

206.16707 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.17435 148.3
[M+Na]+ 229.15629 155.2
[M-H]- 205.15979 154.6
[M+NH4]+ 224.20089 170.6
[M+K]+ 245.13023 154.0
[M+H-H2O]+ 189.16433 143.4
[M+HCOO]- 251.16527 167.5
[M+CH3COO]- 265.18092 188.0
[M+Na-2H]- 227.14174 151.0
[M]+ 206.16652 147.1
[M]- 206.16762 147.1
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

patents stripe