CID 10888236

6,7,8,9-tetrahydro-5h-benzo[7]annulen-2-ol

Structural Information

Molecular Formula
C11H14O
SMILES
C1CCC2=C(CC1)C=C(C=C2)O
InChI
InChI=1S/C11H14O/c12-11-7-6-9-4-2-1-3-5-10(9)8-11/h6-8,12H,1-5H2
InChIKey
NLTRUPDJDOOHGC-UHFFFAOYSA-N
Compound name
6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

162.10446 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.11174 131.1
[M+Na]+ 185.09368 142.0
[M+NH4]+ 180.13828 140.4
[M+K]+ 201.06762 136.6
[M-H]- 161.09718 133.9
[M+Na-2H]- 183.07913 137.8
[M]+ 162.10391 133.5
[M]- 162.10501 133.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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