CID 431987

5-methoxy-n-methyl-2,3-dihydro-1h-inden-1-amine

Structural Information

Molecular Formula
C11H15NO
SMILES
CNC1CCC2=C1C=CC(=C2)OC
InChI
InChI=1S/C11H15NO/c1-12-11-6-3-8-7-9(13-2)4-5-10(8)11/h4-5,7,11-12H,3,6H2,1-2H3
InChIKey
XAPXNLVCUYGNLH-UHFFFAOYSA-N
Compound name
5-methoxy-N-methyl-2,3-dihydro-1H-inden-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

5
Patents

177.11537 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.12265 137.7
[M+Na]+ 200.10459 149.3
[M+NH4]+ 195.14919 147.6
[M+K]+ 216.07853 144.1
[M-H]- 176.10809 141.0
[M+Na-2H]- 198.09004 143.5
[M]+ 177.11482 140.2
[M]- 177.11592 140.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe