CID 174183

4,7-methano-1h-inden-5-ol, 3a,4,5,6,7,7a-hexahydrodimethyl-

Structural Information

Molecular Formula
C12H18O
SMILES
CC1C2C3CC(C2C=C1C)C(C3)O
InChI
InChI=1S/C12H18O/c1-6-3-10-9-4-8(5-11(9)13)12(10)7(6)2/h3,7-13H,4-5H2,1-2H3
InChIKey
WJYPOGJOWNDSPL-UHFFFAOYSA-N
Compound name
3,4-dimethyltricyclo[5.2.1.02,6]dec-4-en-8-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

1
Patents

178.13577 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.14305 144.1
[M+Na]+ 201.12499 153.1
[M-H]- 177.12849 147.5
[M+NH4]+ 196.16959 172.2
[M+K]+ 217.09893 149.6
[M+H-H2O]+ 161.13303 141.8
[M+HCOO]- 223.13397 163.6
[M+CH3COO]- 237.14962 157.8
[M+Na-2H]- 199.11044 144.0
[M]+ 178.13522 143.7
[M]- 178.13632 143.7
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