CID 59018943

K8r4083bcl

Structural Information

Molecular Formula
C18H32O
SMILES
CC1C(C2CCCC3C2(C1(C)C)CC(O3)(C)C)(C)C
InChI
InChI=1S/C18H32O/c1-12-16(4,5)13-9-8-10-14-18(13,17(12,6)7)11-15(2,3)19-14/h12-14H,8-11H2,1-7H3
InChIKey
SVKODZVCLKPVPY-UHFFFAOYSA-N
Compound name
2,2,7,7,8,9,9-heptamethyl-3a,4,5,6,6a,8-hexahydro-1H-cyclopenta[d][1]benzofuran
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

45
Patents

264.24533 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.25261 160.2
[M+Na]+ 287.23455 169.1
[M+NH4]+ 282.27915 175.4
[M+K]+ 303.20849 159.3
[M-H]- 263.23805 164.0
[M+Na-2H]- 285.22000 166.4
[M]+ 264.24478 163.2
[M]- 264.24588 163.2
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