CID 10797825

(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanol

Structural Information

Molecular Formula
C12H16O2
SMILES
COC1=CC2=C(CCC(C2)CO)C=C1
InChI
InChI=1S/C12H16O2/c1-14-12-5-4-10-3-2-9(8-13)6-11(10)7-12/h4-5,7,9,13H,2-3,6,8H2,1H3
InChIKey
XDSRGROSZZUGOM-UHFFFAOYSA-N
Compound name
(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

192.11504 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.12232 141.1
[M+Na]+ 215.10426 148.0
[M-H]- 191.10776 144.0
[M+NH4]+ 210.14886 161.3
[M+K]+ 231.07820 145.1
[M+H-H2O]+ 175.11230 135.4
[M+HCOO]- 237.11324 160.6
[M+CH3COO]- 251.12889 182.2
[M+Na-2H]- 213.08971 147.1
[M]+ 192.11449 139.8
[M]- 192.11559 139.8
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