CID 54595604

1-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-2-ol hydrochloride

Structural Information

Molecular Formula
C11H15NO
SMILES
C1CCC2=C(C1)C=CC(=C2CN)O
InChI
InChI=1S/C11H15NO/c12-7-10-9-4-2-1-3-8(9)5-6-11(10)13/h5-6,13H,1-4,7,12H2
InChIKey
AXQHSQFIBBLDJZ-UHFFFAOYSA-N
Compound name
1-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

177.11537 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.12265 137.4
[M+Na]+ 200.10459 144.0
[M-H]- 176.10809 139.9
[M+NH4]+ 195.14919 157.7
[M+K]+ 216.07853 140.4
[M+H-H2O]+ 160.11263 131.8
[M+HCOO]- 222.11357 157.5
[M+CH3COO]- 236.12922 181.4
[M+Na-2H]- 198.09004 143.3
[M]+ 177.11482 132.6
[M]- 177.11592 132.6
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