CID 106946

Decahydro-6,9,9-trimethyl-1,4-methanonaphthalene

Structural Information

Molecular Formula
C14H24
SMILES
CC1CCC2C3CCC(C2C1)C3(C)C
InChI
InChI=1S/C14H24/c1-9-4-5-10-11(8-9)13-7-6-12(10)14(13,2)3/h9-13H,4-8H2,1-3H3
InChIKey
CRDREESKXHONIB-UHFFFAOYSA-N
Compound name
4,11,11-trimethyltricyclo[6.2.1.02,7]undecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

192.1878 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.19508 149.5
[M+Na]+ 215.17702 156.5
[M-H]- 191.18052 152.8
[M+NH4]+ 210.22162 177.7
[M+K]+ 231.15096 152.5
[M+H-H2O]+ 175.18506 145.6
[M+HCOO]- 237.18600 165.9
[M+CH3COO]- 251.20165 162.0
[M+Na-2H]- 213.16247 150.5
[M]+ 192.18725 146.0
[M]- 192.18835 146.0
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