CID 5127431

5-methyl-5,6,7,8-tetrahydronaphthalen-2-ol

Structural Information

Molecular Formula
C11H14O
SMILES
CC1CCCC2=C1C=CC(=C2)O
InChI
InChI=1S/C11H14O/c1-8-3-2-4-9-7-10(12)5-6-11(8)9/h5-8,12H,2-4H2,1H3
InChIKey
JXRTURJQVVCXIT-UHFFFAOYSA-N
Compound name
5-methyl-5,6,7,8-tetrahydronaphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

162.10446 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.111736 133.1
[M+Na]+ 185.093678 140.5
[M-H]- 161.097184 136.2
[M+NH4]+ 180.138283 154.6
[M+K]+ 201.067618 137.4
[M+H-H2O]+ 145.101720 127.9
[M+HCOO]- 207.102661 152.8
[M+CH3COO]- 221.118311 177.1
[M+Na-2H]- 183.079126 139.7
[M]+ 162.10391142 130.0
[M]- 162.10500858 130.0
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

patents stripe