CID 381969

163629-04-7

Structural Information

Molecular Formula
C15H20N2O
SMILES
CC1=CC2=CC=CC=C2N1CC(=O)NCC(C)C
InChI
InChI=1S/C15H20N2O/c1-11(2)9-16-15(18)10-17-12(3)8-13-6-4-5-7-14(13)17/h4-8,11H,9-10H2,1-3H3,(H,16,18)
InChIKey
XZDHSTZDTPPODL-UHFFFAOYSA-N
Compound name
2-(2-methylindol-1-yl)-N-(2-methylpropyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.15756 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.16484 158.4
[M+Na]+ 267.14678 166.3
[M-H]- 243.15028 161.9
[M+NH4]+ 262.19138 177.5
[M+K]+ 283.12072 162.8
[M+H-H2O]+ 227.15482 151.3
[M+HCOO]- 289.15576 181.2
[M+CH3COO]- 303.17141 198.5
[M+Na-2H]- 265.13223 161.5
[M]+ 244.15701 161.3
[M]- 244.15811 161.4
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.