CID 12805950

13414-56-7

Structural Information

Molecular Formula
C8H9NO
SMILES
C1COC2=C1C=CC=C2N
InChI
InChI=1S/C8H9NO/c9-7-3-1-2-6-4-5-10-8(6)7/h1-3H,4-5,9H2
InChIKey
UHHZGSLXPQGPJL-UHFFFAOYSA-N
Compound name
2,3-dihydro-1-benzofuran-7-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

295
Patents

135.06842 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.075696 123.8
[M+Na]+ 158.057638 132.2
[M-H]- 134.061144 128.8
[M+NH4]+ 153.102243 146.8
[M+K]+ 174.031578 131.1
[M+H-H2O]+ 118.065680 118.8
[M+HCOO]- 180.066621 147.7
[M+CH3COO]- 194.082271 138.6
[M+Na-2H]- 156.043086 131.9
[M]+ 135.06787142 122.2
[M]- 135.06896858 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