CID 18524705

1591549-60-8

Structural Information

Molecular Formula
C12H16N2O
SMILES
CC1CC2=CC=CC=C2N1C(=O)C(C)N
InChI
InChI=1S/C12H16N2O/c1-8-7-10-5-3-4-6-11(10)14(8)12(15)9(2)13/h3-6,8-9H,7,13H2,1-2H3
InChIKey
FNFYZMMJAMAITB-UHFFFAOYSA-N
Compound name
2-amino-1-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.12627 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.13355 147.2
[M+Na]+ 227.11549 154.5
[M-H]- 203.11899 150.1
[M+NH4]+ 222.16009 167.5
[M+K]+ 243.08943 151.8
[M+H-H2O]+ 187.12353 140.9
[M+HCOO]- 249.12447 167.5
[M+CH3COO]- 263.14012 189.4
[M+Na-2H]- 225.10094 149.1
[M]+ 204.12572 145.3
[M]- 204.12682 145.3
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.