CID 16643031

6-ethoxy-3,4-dihydro-2h-1-benzopyran-4-amine

Structural Information

Molecular Formula
C11H15NO2
SMILES
CCOC1=CC2=C(C=C1)OCCC2N
InChI
InChI=1S/C11H15NO2/c1-2-13-8-3-4-11-9(7-8)10(12)5-6-14-11/h3-4,7,10H,2,5-6,12H2,1H3
InChIKey
CPMDPSPSNQSOQS-UHFFFAOYSA-N
Compound name
6-ethoxy-3,4-dihydro-2H-chromen-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.11028 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.11756 140.9
[M+Na]+ 216.09950 147.9
[M-H]- 192.10300 145.4
[M+NH4]+ 211.14410 159.9
[M+K]+ 232.07344 146.7
[M+H-H2O]+ 176.10754 134.6
[M+HCOO]- 238.10848 161.7
[M+CH3COO]- 252.12413 186.0
[M+Na-2H]- 214.08495 148.1
[M]+ 193.10973 140.0
[M]- 193.11083 140.0
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.