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

519
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 124.6
[M+Na]+ 138.08894 134.2
[M+NH4]+ 133.13354 132.5
[M+K]+ 154.06288 129.3
[M-H]- 114.09244 124.1
[M+Na-2H]- 136.07439 128.8
[M]+ 115.09917 125.6
[M]- 115.10027 125.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe