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
2
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]+ 245.164836 158.4
[M+Na]+ 267.146778 166.3
[M-H]- 243.150284 161.9
[M+NH4]+ 262.191383 177.5
[M+K]+ 283.120718 162.8
[M+H-H2O]+ 227.154820 151.3
[M+HCOO]- 289.155761 181.2
[M+CH3COO]- 303.171411 198.5
[M+Na-2H]- 265.132226 161.5
[M]+ 244.15701142 161.4
[M]- 244.15810858 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.