CID 12369044

57786-34-2

Structural Information

Molecular Formula
C8H9NO
SMILES
C1COC2=C1C=CC(=C2)N
InChI
InChI=1S/C8H9NO/c9-7-2-1-6-3-4-10-8(6)5-7/h1-2,5H,3-4,9H2
InChIKey
ZDLCRJZSWKJVQO-UHFFFAOYSA-N
Compound name
2,3-dihydro-1-benzofuran-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

229
Patents

135.06842 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.07570 123.8
[M+Na]+ 158.05764 132.2
[M-H]- 134.06114 128.8
[M+NH4]+ 153.10224 146.8
[M+K]+ 174.03158 131.1
[M+H-H2O]+ 118.06568 118.8
[M+HCOO]- 180.06662 147.7
[M+CH3COO]- 194.08227 138.6
[M+Na-2H]- 156.04309 131.9
[M]+ 135.06787 122.2
[M]- 135.06897 122.2
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

patents stripe