CID 43589776

5,7-dimethoxy-3,4-dihydro-2h-1-benzopyran-4-amine hydrochloride

Structural Information

Molecular Formula
C11H15NO3
SMILES
COC1=CC2=C(C(CCO2)N)C(=C1)OC
InChI
InChI=1S/C11H15NO3/c1-13-7-5-9(14-2)11-8(12)3-4-15-10(11)6-7/h5-6,8H,3-4,12H2,1-2H3
InChIKey
TVMVIJPIRBELNT-UHFFFAOYSA-N
Compound name
5,7-dimethoxy-3,4-dihydro-2H-chromen-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.1052 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.11248 144.0
[M+Na]+ 232.09442 151.8
[M-H]- 208.09792 148.9
[M+NH4]+ 227.13902 162.6
[M+K]+ 248.06836 151.3
[M+H-H2O]+ 192.10246 137.7
[M+HCOO]- 254.10340 165.0
[M+CH3COO]- 268.11905 189.4
[M+Na-2H]- 230.07987 150.6
[M]+ 209.10465 145.0
[M]- 209.10575 145.0
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

No patent data available for this compound.