CID 38250

6-methoxy-1,2,3,4-tetrahydro-1-naphthalenylamine

Structural Information

Molecular Formula
C11H15NO
SMILES
COC1=CC2=C(C=C1)C(CCC2)N
InChI
InChI=1S/C11H15NO/c1-13-9-5-6-10-8(7-9)3-2-4-11(10)12/h5-7,11H,2-4,12H2,1H3
InChIKey
NWDPZDVSZWOAFS-UHFFFAOYSA-N
Compound name
6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

106
Patents

177.11537 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.12265 137.1
[M+Na]+ 200.10459 144.0
[M-H]- 176.10809 140.9
[M+NH4]+ 195.14919 158.0
[M+K]+ 216.07853 141.4
[M+H-H2O]+ 160.11263 131.1
[M+HCOO]- 222.11357 158.6
[M+CH3COO]- 236.12922 183.9
[M+Na-2H]- 198.09004 143.4
[M]+ 177.11482 134.1
[M]- 177.11592 134.1
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