CID 57721978

Ec 415-460-1

Structural Information

Molecular Formula
C17H28O2
SMILES
CC1(CCC2(C3C14CCC(C4)C3(C)C)OCCO2)C
InChI
InChI=1S/C17H28O2/c1-14(2)7-8-17(18-9-10-19-17)13-15(3,4)12-5-6-16(13,14)11-12/h12-13H,5-11H2,1-4H3
InChIKey
RTPMDRYHLHGFGT-UHFFFAOYSA-N
Compound name
2',2',8',8'-tetramethylspiro[1,3-dioxolane-2,10'-octahydro-1H-2,4a-methanonapthalene]
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

162
Patents

264.20892 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.21620 160.2
[M+Na]+ 287.19814 167.5
[M+NH4]+ 282.24274 175.6
[M+K]+ 303.17208 160.2
[M-H]- 263.20164 164.6
[M+Na-2H]- 285.18359 164.4
[M]+ 264.20837 163.1
[M]- 264.20947 163.1
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