CID 82758110

(1r)-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)ethan-1-amine

Structural Information

Molecular Formula
C11H15NO
SMILES
CC1CC2=C(O1)C=CC(=C2)[C@@H](C)N
InChI
InChI=1S/C11H15NO/c1-7-5-10-6-9(8(2)12)3-4-11(10)13-7/h3-4,6-8H,5,12H2,1-2H3/t7?,8-/m1/s1
InChIKey
CVNWHOLBLSNSPO-BRFYHDHCSA-N
Compound name
(1R)-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.11537 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.12265 139.1
[M+Na]+ 200.10459 146.9
[M-H]- 176.10809 144.1
[M+NH4]+ 195.14919 160.7
[M+K]+ 216.07853 145.5
[M+H-H2O]+ 160.11263 133.9
[M+HCOO]- 222.11357 160.9
[M+CH3COO]- 236.12922 184.3
[M+Na-2H]- 198.09004 143.6
[M]+ 177.11482 138.3
[M]- 177.11592 138.3
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.