CID 12147687

73305-09-6

Structural Information

Molecular Formula
C10H13NO
SMILES
COC1=CC2=C(CC(C2)N)C=C1
InChI
InChI=1S/C10H13NO/c1-12-10-3-2-7-4-9(11)5-8(7)6-10/h2-3,6,9H,4-5,11H2,1H3
InChIKey
HLXHCNWEVQNNKA-UHFFFAOYSA-N
Compound name
5-methoxy-2,3-dihydro-1H-inden-2-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3559
Patents

163.09972 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.106996 133.1
[M+Na]+ 186.088938 141.5
[M-H]- 162.092444 137.5
[M+NH4]+ 181.133543 156.6
[M+K]+ 202.062878 138.9
[M+H-H2O]+ 146.096980 127.9
[M+HCOO]- 208.097921 157.2
[M+CH3COO]- 222.113571 180.5
[M+Na-2H]- 184.074386 138.6
[M]+ 163.09917142 132.0
[M]- 163.10026858 132.0
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