CID 21997002

Bicyclo(4.3.1)decane, 3-methoxy-7,7-dimethyl-10-methylene-

Structural Information

Molecular Formula
C14H24O
SMILES
CC1(CCC2CC(CCC1C2=C)OC)C
InChI
InChI=1S/C14H24O/c1-10-11-7-8-14(2,3)13(10)6-5-12(9-11)15-4/h11-13H,1,5-9H2,2-4H3
InChIKey
FKLSTTWRGDCXOK-UHFFFAOYSA-N
Compound name
3-methoxy-7,7-dimethyl-10-methylidenebicyclo[4.3.1]decane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

332
Patents

208.18271 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.18999 145.3
[M+Na]+ 231.17193 149.8
[M-H]- 207.17543 148.8
[M+NH4]+ 226.21653 166.9
[M+K]+ 247.14587 150.1
[M+H-H2O]+ 191.17997 141.7
[M+HCOO]- 253.18091 160.5
[M+CH3COO]- 267.19656 192.2
[M+Na-2H]- 229.15738 149.0
[M]+ 208.18216 139.6
[M]- 208.18326 139.6
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