CID 90208

N-(1,1-dimethylpropyl)formamide

Structural Information

Molecular Formula
C6H13NO
SMILES
CCC(C)(C)NC=O
InChI
InChI=1S/C6H13NO/c1-4-6(2,3)7-5-8/h5H,4H2,1-3H3,(H,7,8)
InChIKey
NQHJHACNRXGUQU-UHFFFAOYSA-N
Compound name
N-(2-methylbutan-2-yl)formamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

738
Patents

115.09972 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 124.4
[M+Na]+ 138.08894 131.5
[M-H]- 114.09244 125.0
[M+NH4]+ 133.13354 147.0
[M+K]+ 154.06288 131.5
[M+H-H2O]+ 98.096980 120.3
[M+HCOO]- 160.09792 148.1
[M+CH3COO]- 174.11357 173.3
[M+Na-2H]- 136.07439 132.3
[M]+ 115.09917 125.1
[M]- 115.10027 125.1
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.