CID 56842534

31996-78-8

Structural Information

Molecular Formula
C10H16O
SMILES
CCC12CC3CC1C2C3OC
InChI
InChI=1S/C10H16O/c1-3-10-5-6-4-7(10)8(10)9(6)11-2/h6-9H,3-5H2,1-2H3
InChIKey
MTDYTPWUZGEKKE-UHFFFAOYSA-N
Compound name
1-ethyl-3-methoxytricyclo[2.2.1.02,6]heptane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

103
Patents

152.12012 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.12740 128.2
[M+Na]+ 175.10934 138.3
[M+NH4]+ 170.15394 141.4
[M+K]+ 191.08328 136.8
[M-H]- 151.11284 134.2
[M+Na-2H]- 173.09479 130.5
[M]+ 152.11957 132.5
[M]- 152.12067 132.5
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