CID 42220784

1392218-75-5

Structural Information

Molecular Formula
C10H13NO2
SMILES
COC1=CC2=C(C=C1)OCC[C@H]2N
InChI
InChI=1S/C10H13NO2/c1-12-7-2-3-10-8(6-7)9(11)4-5-13-10/h2-3,6,9H,4-5,11H2,1H3/t9-/m1/s1
InChIKey
APTWFKUWDZQXHL-SECBINFHSA-N
Compound name
(4R)-6-methoxy-3,4-dihydro-2H-chromen-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

179.09464 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.10192 136.1
[M+Na]+ 202.08386 143.6
[M-H]- 178.08736 140.9
[M+NH4]+ 197.12846 155.7
[M+K]+ 218.05780 142.7
[M+H-H2O]+ 162.09190 130.1
[M+HCOO]- 224.09284 157.4
[M+CH3COO]- 238.10849 183.0
[M+Na-2H]- 200.06931 143.9
[M]+ 179.09409 134.9
[M]- 179.09519 134.9
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.