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]+ 210.112476 144.0
[M+Na]+ 232.094418 151.8
[M-H]- 208.097924 148.9
[M+NH4]+ 227.139023 162.6
[M+K]+ 248.068358 151.3
[M+H-H2O]+ 192.102460 137.7
[M+HCOO]- 254.103401 165.0
[M+CH3COO]- 268.119051 189.4
[M+Na-2H]- 230.079866 150.6
[M]+ 209.10465142 145.0
[M]- 209.10574858 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.