CID 192599

152623-93-3

Structural Information

Molecular Formula
C11H15NO
SMILES
CC(CC1=CC2=C(CCO2)C=C1)N
InChI
InChI=1S/C11H15NO/c1-8(12)6-9-2-3-10-4-5-13-11(10)7-9/h2-3,7-8H,4-6,12H2,1H3
InChIKey
VRNGXHJGMCJRSQ-UHFFFAOYSA-N
Compound name
1-(2,3-dihydro-1-benzofuran-6-yl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

60
Patents

177.11537 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.122646 139.2
[M+Na]+ 200.104588 146.0
[M-H]- 176.108094 143.7
[M+NH4]+ 195.149193 160.5
[M+K]+ 216.078528 144.6
[M+H-H2O]+ 160.112630 133.7
[M+HCOO]- 222.113571 161.0
[M+CH3COO]- 236.129221 183.2
[M+Na-2H]- 198.090036 144.3
[M]+ 177.11482142 138.0
[M]- 177.11591858 138.0
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.