CID 21156169

102242-81-9

Structural Information

Molecular Formula
C13H20O
SMILES
CC1=CCC2C1C3CC2C(C3)(C)OC
InChI
InChI=1S/C13H20O/c1-8-4-5-10-11-6-9(12(8)10)7-13(11,2)14-3/h4,9-12H,5-7H2,1-3H3
InChIKey
NDJHUNNKHIQBFW-UHFFFAOYSA-N
Compound name
8-methoxy-3,8-dimethyltricyclo[5.2.1.02,6]dec-3-ene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

192.15141 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.15869 148.3
[M+Na]+ 215.14063 157.5
[M-H]- 191.14413 152.8
[M+NH4]+ 210.18523 178.3
[M+K]+ 231.11457 154.3
[M+H-H2O]+ 175.14867 145.5
[M+HCOO]- 237.14961 169.0
[M+CH3COO]- 251.16526 162.3
[M+Na-2H]- 213.12608 149.7
[M]+ 192.15086 149.9
[M]- 192.15196 149.9
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

No patent data available for this compound.