CID 2752684

Cis-1,3,4,8b-tetrahydro-4a(2h)-biphenylenol

Structural Information

Molecular Formula
C12H14O
SMILES
C1CCC2(C(C1)C3=CC=CC=C32)O
InChI
InChI=1S/C12H14O/c13-12-8-4-3-7-11(12)9-5-1-2-6-10(9)12/h1-2,5-6,11,13H,3-4,7-8H2
InChIKey
RINGNMPHLXPJRL-UHFFFAOYSA-N
Compound name
2,3,4,8b-tetrahydro-1H-biphenylen-4a-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.10446 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.11174 134.1
[M+Na]+ 197.09368 141.0
[M-H]- 173.09718 138.2
[M+NH4]+ 192.13828 151.5
[M+K]+ 213.06762 140.4
[M+H-H2O]+ 157.10172 124.5
[M+HCOO]- 219.10266 151.8
[M+CH3COO]- 233.11831 146.8
[M+Na-2H]- 195.07913 143.1
[M]+ 174.10391 139.9
[M]- 174.10501 139.9
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

No patent data available for this compound.