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]+ 196.13321 145.9
[M+Na]+ 218.11515 151.8
[M-H]- 194.11865 150.1
[M+NH4]+ 213.15975 165.5
[M+K]+ 234.08909 152.2
[M+H-H2O]+ 178.12319 140.6
[M+HCOO]- 240.12413 167.7
[M+CH3COO]- 254.13978 186.7
[M+Na-2H]- 216.10060 150.4
[M]+ 195.12538 147.4
[M]- 195.12648 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.