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]+ 205.133546 147.2
[M+Na]+ 227.115488 154.5
[M-H]- 203.118994 150.1
[M+NH4]+ 222.160093 167.5
[M+K]+ 243.089428 151.8
[M+H-H2O]+ 187.123530 140.9
[M+HCOO]- 249.124471 167.5
[M+CH3COO]- 263.140121 189.4
[M+Na-2H]- 225.100936 149.1
[M]+ 204.12572142 145.3
[M]- 204.12681858 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.