CID 208087

31634-30-7

Structural Information

Molecular Formula
C11H17NO2
SMILES
CC(C(=O)C1=CC=CO1)NC(C)(C)C
InChI
InChI=1S/C11H17NO2/c1-8(12-11(2,3)4)10(13)9-6-5-7-14-9/h5-8,12H,1-4H3
InChIKey
KQERXGPGIZOUKH-UHFFFAOYSA-N
Compound name
2-(tert-butylamino)-1-(furan-2-yl)propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.12593 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.133206 145.9
[M+Na]+ 218.115148 151.8
[M-H]- 194.118654 150.1
[M+NH4]+ 213.159753 165.5
[M+K]+ 234.089088 152.2
[M+H-H2O]+ 178.123190 140.6
[M+HCOO]- 240.124131 167.7
[M+CH3COO]- 254.139781 186.7
[M+Na-2H]- 216.100596 150.4
[M]+ 195.12538142 147.4
[M]- 195.12647858 147.4
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.