CID 92030006

476332-65-7

Structural Information

Molecular Formula
C18H32O
SMILES
CC1C(C2CCC3CC(OC3C2C1(C)C)(C)C)(C)C
InChI
InChI=1S/C18H32O/c1-11-17(4,5)13-9-8-12-10-16(2,3)19-15(12)14(13)18(11,6)7/h11-15H,8-10H2,1-7H3
InChIKey
HUYXPANWJVOYCI-UHFFFAOYSA-N
Compound name
2,2,6,6,7,8,8-heptamethyl-3,3a,4,5,5a,7,8a,8b-octahydrocyclopenta[g][1]benzofuran
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

125
Patents

264.24533 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.25261 163.0
[M+Na]+ 287.23455 172.3
[M+NH4]+ 282.27915 177.0
[M+K]+ 303.20849 163.9
[M-H]- 263.23805 166.6
[M+Na-2H]- 285.22000 166.8
[M]+ 264.24478 165.9
[M]- 264.24588 165.9
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

patents stripe